4-(aminomethyl)-3-methylbenzamide;4-aminoperoxysulfanyl-3-methylbenzamide;2-bromo-4-methylpyridine;2-bromo-5-methylpyridine;2-chloro-4-methylpyridine;2-chloro-5-methylpyridine;2,5-dimethylpyridine;4-fluoro-3-methylbenzamide;6-fluoro-2-methyl-3-methylperoxysulfanylnaphthalene;4-isocyano-3-methylbenzamide;2-methoxy-5-methylpyridine;3-methylbenzamide;2-methylbenzene-1,4-dicarboxamide;3-methyl-4-methylperoxysulfanylbenzamide;3-methyl-4-nitrobenzamide;3-methyl-4-nitrobenzenecarboximidamide;4-methylpyridazine;3-methylpyridine;4-methylpyridine;4-methylpyridine-2-carboxamide;4-methylpyridine-2-carboximidamide;(4-methyl-2-pyridinyl)methanamine

C164H185Br2Cl2F2N33O21S3 — CID 160843383

IUPAC4-(aminomethyl)-3-methylbenzamide;4-aminoperoxysulfanyl-3-methylbenzamide;2-bromo-4-methylpyridine;2-bromo-5-methylpyridine;2-chloro-4-methylpyridine;2-chloro-5-methylpyridine;2,5-dimethylpyridine;4-fluoro-3-methylbenzamide;6-fluoro-2-methyl-3-methylperoxysulfanylnaphthalene;4-isocyano-3-methylbenzamide;2-methoxy-5-methylpyridine;3-methylbenzamide;2-methylbenzene-1,4-dicarboxamide;3-methyl-4-methylperoxysulfanylbenzamide;3-methyl-4-nitrobenzamide;3-methyl-4-nitrobenzenecarboximidamide;4-methylpyridazine;3-methylpyridine;4-methylpyridine;4-methylpyridine-2-carboxamide;4-methylpyridine-2-carboximidamide;(4-methyl-2-pyridinyl)methanamine
SMILESCOOSc1cc2cc(F)ccc2cc1C.COOSc1ccc(C(N)=O)cc1C.COc1ccc(C)cn1.Cc1cc(C(N)=O)ccc1C(N)=O.Cc1cc(C(N)=O)ccc1CN.Cc1cc(C(N)=O)ccc1F.Cc1cc(C(N)=O)ccc1SOON.Cc1cc(C(N)=O)ccc1[N+](=O)[O-].Cc1ccc(Br)nc1.Cc1ccc(C)nc1.Cc1ccc(Cl)nc1.Cc1cccc(C(N)=O)c1.Cc1cccnc1.Cc1ccnc(Br)c1.Cc1ccnc(C(N)=O)c1.Cc1ccnc(CN)c1.Cc1ccnc(Cl)c1.Cc1ccncc1.Cc1ccnnc1.[C-]#[N+]c1ccc(C(N)=O)cc1C.[H]/N=C(\N)c1cc(C)ccn1.[H]/N=C(\N)c1ccc([N+](=O)[O-])c(C)c1
InChIInChI=1S/C12H11FO2S.C9H10N2O2.C9H8N2O.C9H12N2O.C9H11NO3S.C8H8FNO.C8H9N3O2.C8H10N2O3S.C8H8N2O3.C8H9NO.C7H9N3.C7H8N2O.C7H10N2.C7H9NO.C7H9N.2C6H6BrN.2C6H6ClN.2C6H7N.C5H6N2/c1-8-5-9-3-4-11(13)6-10(9)7-12(8)16-15-14-2;1-5-4-6(8(10)12)2-3-7(5)9(11)13;1-6-5-7(9(10)12)3-4-8(6)11-2;1-6-4-7(9(11)12)2-3-8(6)5-10;1-6-5-7(9(10)11)3-4-8(6)14-13-12-2;1-5-4-6(8(10)11)2-3-7(5)9;1-5-4-6(8(9)10)2-3-7(5)11(12)13;1-5-4-6(8(9)11)2-3-7(5)14-13-12-10;1-5-4-6(8(9)11)2-3-7(5)10(12)13;1-6-3-2-4-7(5-6)8(9)10;1-5-2-3-10-6(4-5)7(8)9;1-5-2-3-9-6(4-5)7(8)10;1-6-2-3-9-7(4-6)5-8;1-6-3-4-7(9-2)8-5-6;1-6-3-4-7(2)8-5-6;1-5-2-3-8-6(7)4-5;1-5-2-3-6(7)8-4-5;1-5-2-3-8-6(7)4-5;1-5-2-3-6(7)8-4-5;1-6-2-4-7-5-3-6;1-6-3-2-4-7-5-6;1-5-2-3-6-7-4-5/h3-7H,1-2H3;2-4H,1H3,(H2,10,12)(H2,11,13);3-5H,1H3,(H2,10,12);2-4H,5,10H2,1H3,(H2,11,12);3-5H,1-2H3,(H2,10,11);2-4H,1H3,(H2,10,11);2-4H,1H3,(H3,9,10);2-4H,10H2,1H3,(H2,9,11);2-4H,1H3,(H2,9,11);2-5H,1H3,(H2,9,10);2-4H,1H3,(H3,8,9);2-4H,1H3,(H2,8,10);2-4H,5,8H2,1H3;3-5H,1-2H3;3-5H,1-2H3;4*2-4H,1H3;2*2-5H,1H3;2-4H,1H3
InChIKeySIIAYKYVSLWMLV-UHFFFAOYSA-N
MW3319.40 g/mol
LogP30.45
Rot. Bonds26

About 4-(aminomethyl)-3-methylbenzamide;4-aminoperoxysulfanyl-3-methylbenzamide;2-bromo-4-methylpyridine;2-bromo-5-methylpyridine;2-chloro-4-methylpyridine;2-chloro-5-methylpyridine;2,5-dimethylpyridine;4-fluoro-3-methylbenzamide;6-fluoro-2-methyl-3-methylperoxysulfanylnaphthalene;4-isocyano-3-methylbenzamide;2-methoxy-5-methylpyridine;3-methylbenzamide;2-methylbenzene-1,4-dicarboxamide;3-methyl-4-methylperoxysulfanylbenzamide;3-methyl-4-nitrobenzamide;3-methyl-4-nitrobenzenecarboximidamide;4-methylpyridazine;3-methylpyridine;4-methylpyridine;4-methylpyridine-2-carboxamide;4-methylpyridine-2-carboximidamide;(4-methyl-2-pyridinyl)methanamine

4-(aminomethyl)-3-methylbenzamide;4-aminoperoxysulfanyl-3-methylbenzamide;2-bromo-4-methylpyridine;2-bromo-5-methylpyridine;2-chloro-4-methylpyridine;2-chloro-5-methylpyridine;2,5-dimethylpyridine;4-fluoro-3-methylbenzamide;6-fluoro-2-methyl-3-methylperoxysulfanylnaphthalene;4-isocyano-3-methylbenzamide;2-methoxy-5-methylpyridine;3-methylbenzamide;2-methylbenzene-1,4-dicarboxamide;3-methyl-4-methylperoxysulfanylbenzamide;3-methyl-4-nitrobenzamide;3-methyl-4-nitrobenzenecarboximidamide;4-methylpyridazine;3-methylpyridine;4-methylpyridine;4-methylpyridine-2-carboxamide;4-methylpyridine-2-carboximidamide;(4-methyl-2-pyridinyl)methanamine (PubChem CID 160843383) has the molecular formula C164H185Br2Cl2F2N33O21S3 and a molecular weight of 3319.40 g/mol. Its IUPAC name is 4-(aminomethyl)-3-methylbenzamide;4-aminoperoxysulfanyl-3-methylbenzamide;2-bromo-4-methylpyridine;2-bromo-5-methylpyridine;2-chloro-4-methylpyridine;2-chloro-5-methylpyridine;2,5-dimethylpyridine;4-fluoro-3-methylbenzamide;6-fluoro-2-methyl-3-methylperoxysulfanylnaphthalene;4-isocyano-3-methylbenzamide;2-methoxy-5-methylpyridine;3-methylbenzamide;2-methylbenzene-1,4-dicarboxamide;3-methyl-4-methylperoxysulfanylbenzamide;3-methyl-4-nitrobenzamide;3-methyl-4-nitrobenzenecarboximidamide;4-methylpyridazine;3-methylpyridine;4-methylpyridine;4-methylpyridine-2-carboxamide;4-methylpyridine-2-carboximidamide;(4-methyl-2-pyridinyl)methanamine.

Molecular Properties

Compound Name4-(aminomethyl)-3-methylbenzamide;4-aminoperoxysulfanyl-3-methylbenzamide;2-bromo-4-methylpyridine;2-bromo-5-methylpyridine;2-chloro-4-methylpyridine;2-chloro-5-methylpyridine;2,5-dimethylpyridine;4-fluoro-3-methylbenzamide;6-fluoro-2-methyl-3-methylperoxysulfanylnaphthalene;4-isocyano-3-methylbenzamide;2-methoxy-5-methylpyridine;3-methylbenzamide;2-methylbenzene-1,4-dicarboxamide;3-methyl-4-methylperoxysulfanylbenzamide;3-methyl-4-nitrobenzamide;3-methyl-4-nitrobenzenecarboximidamide;4-methylpyridazine;3-methylpyridine;4-methylpyridine;4-methylpyridine-2-carboxamide;4-methylpyridine-2-carboximidamide;(4-methyl-2-pyridinyl)methanamine
PubChem CID160843383
Molecular FormulaC164H185Br2Cl2F2N33O21S3
Molecular Weight3319.40 g/mol
Exact Mass3314.13
IUPAC Name4-(aminomethyl)-3-methylbenzamide;4-aminoperoxysulfanyl-3-methylbenzamide;2-bromo-4-methylpyridine;2-bromo-5-methylpyridine;2-chloro-4-methylpyridine;2-chloro-5-methylpyridine;2,5-dimethylpyridine;4-fluoro-3-methylbenzamide;6-fluoro-2-methyl-3-methylperoxysulfanylnaphthalene;4-isocyano-3-methylbenzamide;2-methoxy-5-methylpyridine;3-methylbenzamide;2-methylbenzene-1,4-dicarboxamide;3-methyl-4-methylperoxysulfanylbenzamide;3-methyl-4-nitrobenzamide;3-methyl-4-nitrobenzenecarboximidamide;4-methylpyridazine;3-methylpyridine;4-methylpyridine;4-methylpyridine-2-carboxamide;4-methylpyridine-2-carboximidamide;(4-methyl-2-pyridinyl)methanamine
SMILESCOOSc1cc2cc(F)ccc2cc1C.COOSc1ccc(C(N)=O)cc1C.COc1ccc(C)cn1.Cc1cc(C(N)=O)ccc1C(N)=O.Cc1cc(C(N)=O)ccc1CN.Cc1cc(C(N)=O)ccc1F.Cc1cc(C(N)=O)ccc1SOON.Cc1cc(C(N)=O)ccc1[N+](=O)[O-].Cc1ccc(Br)nc1.Cc1ccc(C)nc1.Cc1ccc(Cl)nc1.Cc1cccc(C(N)=O)c1.Cc1cccnc1.Cc1ccnc(Br)c1.Cc1ccnc(C(N)=O)c1.Cc1ccnc(CN)c1.Cc1ccnc(Cl)c1.Cc1ccncc1.Cc1ccnnc1.[C-]#[N+]c1ccc(C(N)=O)cc1C.[H]/N=C(\N)c1cc(C)ccn1.[H]/N=C(\N)c1ccc([N+](=O)[O-])c(C)c1
InChIInChI=1S/C12H11FO2S.C9H10N2O2.C9H8N2O.C9H12N2O.C9H11NO3S.C8H8FNO.C8H9N3O2.C8H10N2O3S.C8H8N2O3.C8H9NO.C7H9N3.C7H8N2O.C7H10N2.C7H9NO.C7H9N.2C6H6BrN.2C6H6ClN.2C6H7N.C5H6N2/c1-8-5-9-3-4-11(13)6-10(9)7-12(8)16-15-14-2;1-5-4-6(8(10)12)2-3-7(5)9(11)13;1-6-5-7(9(10)12)3-4-8(6)11-2;1-6-4-7(9(11)12)2-3-8(6)5-10;1-6-5-7(9(10)11)3-4-8(6)14-13-12-2;1-5-4-6(8(10)11)2-3-7(5)9;1-5-4-6(8(9)10)2-3-7(5)11(12)13;1-5-4-6(8(9)11)2-3-7(5)14-13-12-10;1-5-4-6(8(9)11)2-3-7(5)10(12)13;1-6-3-2-4-7(5-6)8(9)10;1-5-2-3-10-6(4-5)7(8)9;1-5-2-3-9-6(4-5)7(8)10;1-6-2-3-9-7(4-6)5-8;1-6-3-4-7(9-2)8-5-6;1-6-3-4-7(2)8-5-6;1-5-2-3-8-6(7)4-5;1-5-2-3-6(7)8-4-5;1-5-2-3-8-6(7)4-5;1-5-2-3-6(7)8-4-5;1-6-2-4-7-5-3-6;1-6-3-2-4-7-5-6;1-5-2-3-6-7-4-5/h3-7H,1-2H3;2-4H,1H3,(H2,10,12)(H2,11,13);3-5H,1H3,(H2,10,12);2-4H,5,10H2,1H3,(H2,11,12);3-5H,1-2H3,(H2,10,11);2-4H,1H3,(H2,10,11);2-4H,1H3,(H3,9,10);2-4H,10H2,1H3,(H2,9,11);2-4H,1H3,(H2,9,11);2-5H,1H3,(H2,9,10);2-4H,1H3,(H3,8,9);2-4H,1H3,(H2,8,10);2-4H,5,8H2,1H3;3-5H,1-2H3;3-5H,1-2H3;4*2-4H,1H3;2*2-5H,1H3;2-4H,1H3
InChIKeySIIAYKYVSLWMLV-UHFFFAOYSA-N
XLogP30.45
TPSA931.52 Ų
H-Bond Donors17
H-Bond Acceptors42
Rotatable Bonds26
Heavy Atoms227
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003319.40
LogP ≤ 530.45
H-Bond Donors ≤ 517
H-Bond Acceptors ≤ 1042

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}

Analyze 4-(aminomethyl)-3-methylbenzamide;4-aminoperoxysulfanyl-3-methylbenzamide;2-bromo-4-methylpyridine;2-bromo-5-methylpyridine;2-chloro-4-methylpyridine;2-chloro-5-methylpyridine;2,5-dimethylpyridine;4-fluoro-3-methylbenzamide;6-fluoro-2-methyl-3-methylperoxysulfanylnaphthalene;4-isocyano-3-methylbenzamide;2-methoxy-5-methylpyridine;3-methylbenzamide;2-methylbenzene-1,4-dicarboxamide;3-methyl-4-methylperoxysulfanylbenzamide;3-methyl-4-nitrobenzamide;3-methyl-4-nitrobenzenecarboximidamide;4-methylpyridazine;3-methylpyridine;4-methylpyridine;4-methylpyridine-2-carboxamide;4-methylpyridine-2-carboximidamide;(4-methyl-2-pyridinyl)methanamine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)-3-methylbenzamide;4-aminoperoxysulfanyl-3-methylbenzamide;2-bromo-4-methylpyridine;2-bromo-5-methylpyridine;2-chloro-4-methylpyridine;2-chloro-5-methylpyridine;2,5-dimethylpyridine;4-fluoro-3-methylbenzamide;6-fluoro-2-methyl-3-methylperoxysulfanylnaphthalene;4-isocyano-3-methylbenzamide;2-methoxy-5-methylpyridine;3-methylbenzamide;2-methylbenzene-1,4-dicarboxamide;3-methyl-4-methylperoxysulfanylbenzamide;3-methyl-4-nitrobenzamide;3-methyl-4-nitrobenzenecarboximidamide;4-methylpyridazine;3-methylpyridine;4-methylpyridine;4-methylpyridine-2-carboxamide;4-methylpyridine-2-carboximidamide;(4-methyl-2-pyridinyl)methanamine?
The IUPAC name of 4-(aminomethyl)-3-methylbenzamide;4-aminoperoxysulfanyl-3-methylbenzamide;2-bromo-4-methylpyridine;2-bromo-5-methylpyridine;2-chloro-4-methylpyridine;2-chloro-5-methylpyridine;2,5-dimethylpyridine;4-fluoro-3-methylbenzamide;6-fluoro-2-methyl-3-methylperoxysulfanylnaphthalene;4-isocyano-3-methylbenzamide;2-methoxy-5-methylpyridine;3-methylbenzamide;2-methylbenzene-1,4-dicarboxamide;3-methyl-4-methylperoxysulfanylbenzamide;3-methyl-4-nitrobenzamide;3-methyl-4-nitrobenzenecarboximidamide;4-methylpyridazine;3-methylpyridine;4-methylpyridine;4-methylpyridine-2-carboxamide;4-methylpyridine-2-carboximidamide;(4-methyl-2-pyridinyl)methanamine (CID 160843383) is 4-(aminomethyl)-3-methylbenzamide;4-aminoperoxysulfanyl-3-methylbenzamide;2-bromo-4-methylpyridine;2-bromo-5-methylpyridine;2-chloro-4-methylpyridine;2-chloro-5-methylpyridine;2,5-dimethylpyridine;4-fluoro-3-methylbenzamide;6-fluoro-2-methyl-3-methylperoxysulfanylnaphthalene;4-isocyano-3-methylbenzamide;2-methoxy-5-methylpyridine;3-methylbenzamide;2-methylbenzene-1,4-dicarboxamide;3-methyl-4-methylperoxysulfanylbenzamide;3-methyl-4-nitrobenzamide;3-methyl-4-nitrobenzenecarboximidamide;4-methylpyridazine;3-methylpyridine;4-methylpyridine;4-methylpyridine-2-carboxamide;4-methylpyridine-2-carboximidamide;(4-methyl-2-pyridinyl)methanamine.
What is the SMILES notation for 4-(aminomethyl)-3-methylbenzamide;4-aminoperoxysulfanyl-3-methylbenzamide;2-bromo-4-methylpyridine;2-bromo-5-methylpyridine;2-chloro-4-methylpyridine;2-chloro-5-methylpyridine;2,5-dimethylpyridine;4-fluoro-3-methylbenzamide;6-fluoro-2-methyl-3-methylperoxysulfanylnaphthalene;4-isocyano-3-methylbenzamide;2-methoxy-5-methylpyridine;3-methylbenzamide;2-methylbenzene-1,4-dicarboxamide;3-methyl-4-methylperoxysulfanylbenzamide;3-methyl-4-nitrobenzamide;3-methyl-4-nitrobenzenecarboximidamide;4-methylpyridazine;3-methylpyridine;4-methylpyridine;4-methylpyridine-2-carboxamide;4-methylpyridine-2-carboximidamide;(4-methyl-2-pyridinyl)methanamine?
The canonical SMILES for 4-(aminomethyl)-3-methylbenzamide;4-aminoperoxysulfanyl-3-methylbenzamide;2-bromo-4-methylpyridine;2-bromo-5-methylpyridine;2-chloro-4-methylpyridine;2-chloro-5-methylpyridine;2,5-dimethylpyridine;4-fluoro-3-methylbenzamide;6-fluoro-2-methyl-3-methylperoxysulfanylnaphthalene;4-isocyano-3-methylbenzamide;2-methoxy-5-methylpyridine;3-methylbenzamide;2-methylbenzene-1,4-dicarboxamide;3-methyl-4-methylperoxysulfanylbenzamide;3-methyl-4-nitrobenzamide;3-methyl-4-nitrobenzenecarboximidamide;4-methylpyridazine;3-methylpyridine;4-methylpyridine;4-methylpyridine-2-carboxamide;4-methylpyridine-2-carboximidamide;(4-methyl-2-pyridinyl)methanamine is COOSc1cc2cc(F)ccc2cc1C.COOSc1ccc(C(N)=O)cc1C.COc1ccc(C)cn1.Cc1cc(C(N)=O)ccc1C(N)=O.Cc1cc(C(N)=O)ccc1CN.Cc1cc(C(N)=O)ccc1F.Cc1cc(C(N)=O)ccc1SOON.Cc1cc(C(N)=O)ccc1[N+](=O)[O-].Cc1ccc(Br)nc1.Cc1ccc(C)nc1.Cc1ccc(Cl)nc1.Cc1cccc(C(N)=O)c1.Cc1cccnc1.Cc1ccnc(Br)c1.Cc1ccnc(C(N)=O)c1.Cc1ccnc(CN)c1.Cc1ccnc(Cl)c1.Cc1ccncc1.Cc1ccnnc1.[C-]#[N+]c1ccc(C(N)=O)cc1C.[H]/N=C(\N)c1cc(C)ccn1.[H]/N=C(\N)c1ccc([N+](=O)[O-])c(C)c1.
What is the InChIKey of 4-(aminomethyl)-3-methylbenzamide;4-aminoperoxysulfanyl-3-methylbenzamide;2-bromo-4-methylpyridine;2-bromo-5-methylpyridine;2-chloro-4-methylpyridine;2-chloro-5-methylpyridine;2,5-dimethylpyridine;4-fluoro-3-methylbenzamide;6-fluoro-2-methyl-3-methylperoxysulfanylnaphthalene;4-isocyano-3-methylbenzamide;2-methoxy-5-methylpyridine;3-methylbenzamide;2-methylbenzene-1,4-dicarboxamide;3-methyl-4-methylperoxysulfanylbenzamide;3-methyl-4-nitrobenzamide;3-methyl-4-nitrobenzenecarboximidamide;4-methylpyridazine;3-methylpyridine;4-methylpyridine;4-methylpyridine-2-carboxamide;4-methylpyridine-2-carboximidamide;(4-methyl-2-pyridinyl)methanamine?
The InChIKey is SIIAYKYVSLWMLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11FO2S.C9H10N2O2.C9H8N2O.C9H12N2O.C9H11NO3S.C8H8FNO.C8H9N3O2.C8H10N2O3S.C8H8N2O3.C8H9NO.C7H9N3.C7H8N2O.C7H10N2.C7H9NO.C7H9N.2C6H6BrN.2C6H6ClN.2C6H7N.C5H6N2/c1-8-5-9-3-4-11(13)6-10(9)7-12(8)16-15-14-2;1-5-4-6(8(10)12)2-3-7(5)9(11)13;1-6-5-7(9(10)12)3-4-8(6)11-2;1-6-4-7(9(11)12)2-3-8(6)5-10;1-6-5-7(9(10)11)3-4-8(6)14-13-12-2;1-5-4-6(8(10)11)2-3-7(5)9;1-5-4-6(8(9)10)2-3-7(5)11(12)13;1-5-4-6(8(9)11)2-3-7(5)14-13-12-10;1-5-4-6(8(9)11)2-3-7(5)10(12)13;1-6-3-2-4-7(5-6)8(9)10;1-5-2-3-10-6(4-5)7(8)9;1-5-2-3-9-6(4-5)7(8)10;1-6-2-3-9-7(4-6)5-8;1-6-3-4-7(9-2)8-5-6;1-6-3-4-7(2)8-5-6;1-5-2-3-8-6(7)4-5;1-5-2-3-6(7)8-4-5;1-5-2-3-8-6(7)4-5;1-5-2-3-6(7)8-4-5;1-6-2-4-7-5-3-6;1-6-3-2-4-7-5-6;1-5-2-3-6-7-4-5/h3-7H,1-2H3;2-4H,1H3,(H2,10,12)(H2,11,13);3-5H,1H3,(H2,10,12);2-4H,5,10H2,1H3,(H2,11,12);3-5H,1-2H3,(H2,10,11);2-4H,1H3,(H2,10,11);2-4H,1H3,(H3,9,10);2-4H,10H2,1H3,(H2,9,11);2-4H,1H3,(H2,9,11);2-5H,1H3,(H2,9,10);2-4H,1H3,(H3,8,9);2-4H,1H3,(H2,8,10);2-4H,5,8H2,1H3;3-5H,1-2H3;3-5H,1-2H3;4*2-4H,1H3;2*2-5H,1H3;2-4H,1H3.
What are the key properties of 4-(aminomethyl)-3-methylbenzamide;4-aminoperoxysulfanyl-3-methylbenzamide;2-bromo-4-methylpyridine;2-bromo-5-methylpyridine;2-chloro-4-methylpyridine;2-chloro-5-methylpyridine;2,5-dimethylpyridine;4-fluoro-3-methylbenzamide;6-fluoro-2-methyl-3-methylperoxysulfanylnaphthalene;4-isocyano-3-methylbenzamide;2-methoxy-5-methylpyridine;3-methylbenzamide;2-methylbenzene-1,4-dicarboxamide;3-methyl-4-methylperoxysulfanylbenzamide;3-methyl-4-nitrobenzamide;3-methyl-4-nitrobenzenecarboximidamide;4-methylpyridazine;3-methylpyridine;4-methylpyridine;4-methylpyridine-2-carboxamide;4-methylpyridine-2-carboximidamide;(4-methyl-2-pyridinyl)methanamine?
4-(aminomethyl)-3-methylbenzamide;4-aminoperoxysulfanyl-3-methylbenzamide;2-bromo-4-methylpyridine;2-bromo-5-methylpyridine;2-chloro-4-methylpyridine;2-chloro-5-methylpyridine;2,5-dimethylpyridine;4-fluoro-3-methylbenzamide;6-fluoro-2-methyl-3-methylperoxysulfanylnaphthalene;4-isocyano-3-methylbenzamide;2-methoxy-5-methylpyridine;3-methylbenzamide;2-methylbenzene-1,4-dicarboxamide;3-methyl-4-methylperoxysulfanylbenzamide;3-methyl-4-nitrobenzamide;3-methyl-4-nitrobenzenecarboximidamide;4-methylpyridazine;3-methylpyridine;4-methylpyridine;4-methylpyridine-2-carboxamide;4-methylpyridine-2-carboximidamide;(4-methyl-2-pyridinyl)methanamine has a molecular weight of 3319.40 g/mol, XLogP of 30.45, 26 rotatable bonds, 17 hydrogen bond donors, and 42 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-3-methylbenzamide;4-aminoperoxysulfanyl-3-methylbenzamide;2-bromo-4-methylpyridine;2-bromo-5-methylpyridine;2-chloro-4-methylpyridine;2-chloro-5-methylpyridine;2,5-dimethylpyridine;4-fluoro-3-methylbenzamide;6-fluoro-2-methyl-3-methylperoxysulfanylnaphthalene;4-isocyano-3-methylbenzamide;2-methoxy-5-methylpyridine;3-methylbenzamide;2-methylbenzene-1,4-dicarboxamide;3-methyl-4-methylperoxysulfanylbenzamide;3-methyl-4-nitrobenzamide;3-methyl-4-nitrobenzenecarboximidamide;4-methylpyridazine;3-methylpyridine;4-methylpyridine;4-methylpyridine-2-carboxamide;4-methylpyridine-2-carboximidamide;(4-methyl-2-pyridinyl)methanamine is sourced from PubChem (CID 160843383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).