cumene;N,N-dimethyl-1-(4-propan-2-yl-2-pyridinyl)methanamine;2-methoxy-5-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;2-methyl-4-propan-2-ylpyridine;1-(oxan-4-yl)-3-propan-2-ylpyrrole;1-oxido-4-propan-2-ylpyridin-1-ium;2-piperidin-1-yl-4-propan-2-ylpyridine;2-propan-2-yl-1,3-oxazole;2-(3-propan-2-ylphenoxy)ethanamine;N'-(3-propan-2-ylphenyl)ethane-1,2-diamine;4-propan-2-ylpyridin-2-amine;2-propan-2-ylpyridine;(4-propan-2-yl-2-pyridinyl)methanamine;(4-propan-2-yl-2-pyridinyl)methanol;1-(4-propan-2-yl-2-pyridinyl)propan-2-one;2-propan-2-yl-1,3-thiazole;3-propan-2-yl-1-(2,2,2-trifluoroethyl)pyrazole

C164H245F3N24O8S — CID 158859543

IUPACcumene;N,N-dimethyl-1-(4-propan-2-yl-2-pyridinyl)methanamine;2-methoxy-5-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;2-methyl-4-propan-2-ylpyridine;1-(oxan-4-yl)-3-propan-2-ylpyrrole;1-oxido-4-propan-2-ylpyridin-1-ium;2-piperidin-1-yl-4-propan-2-ylpyridine;2-propan-2-yl-1,3-oxazole;2-(3-propan-2-ylphenoxy)ethanamine;N'-(3-propan-2-ylphenyl)ethane-1,2-diamine;4-propan-2-ylpyridin-2-amine;2-propan-2-ylpyridine;(4-propan-2-yl-2-pyridinyl)methanamine;(4-propan-2-yl-2-pyridinyl)methanol;1-(4-propan-2-yl-2-pyridinyl)propan-2-one;2-propan-2-yl-1,3-thiazole;3-propan-2-yl-1-(2,2,2-trifluoroethyl)pyrazole
SMILESCC(=O)Cc1cc(C(C)C)ccn1.CC(C)c1cc[n+]([O-])cc1.CC(C)c1cccc(NCCN)c1.CC(C)c1cccc(OCCN)c1.CC(C)c1ccccc1.CC(C)c1ccccn1.CC(C)c1ccn(C2CCOCC2)c1.CC(C)c1ccn(CC(F)(F)F)n1.CC(C)c1ccnc(CN(C)C)c1.CC(C)c1ccnc(CN)c1.CC(C)c1ccnc(CO)c1.CC(C)c1ccnc(N)c1.CC(C)c1ccnc(N2CCCCC2)c1.CC(C)c1ncco1.CC(C)c1nccs1.COc1ccc(C(C)C)cn1.Cc1cc(C(C)C)ccn1.Cc1nnc(C(C)C)o1
InChIInChI=1S/C13H20N2.C12H19NO.2C11H18N2.C11H15NO.C11H17NO.C9H14N2.2C9H13NO.C9H13N.C9H12.C8H11F3N2.C8H12N2.C8H11NO.C8H11N.C6H10N2O.C6H9NO.C6H9NS/c1-11(2)12-6-7-14-13(10-12)15-8-4-3-5-9-15;1-10(2)11-3-6-13(9-11)12-4-7-14-8-5-12;1-9(2)10-5-6-12-11(7-10)8-13(3)4;1-9(2)10-4-3-5-11(8-10)13-7-6-12;1-8(2)10-4-5-12-11(7-10)6-9(3)13;1-9(2)10-4-3-5-11(8-10)13-7-6-12;1-7(2)8-3-4-11-9(5-8)6-10;1-7(2)8-4-5-9(11-3)10-6-8;1-7(2)8-3-4-10-9(5-8)6-11;1-7(2)9-4-5-10-8(3)6-9;1-8(2)9-6-4-3-5-7-9;1-6(2)7-3-4-13(12-7)5-8(9,10)11;1-6(2)7-3-4-10-8(9)5-7;1-7(2)8-3-5-9(10)6-4-8;1-7(2)8-5-3-4-6-9-8;1-4(2)6-8-7-5(3)9-6;2*1-5(2)6-7-3-4-8-6/h6-7,10-11H,3-5,8-9H2,1-2H3;3,6,9-10,12H,4-5,7-8H2,1-2H3;5-7,9H,8H2,1-4H3;3-5,8-9,13H,6-7,12H2,1-2H3;4-5,7-8H,6H2,1-3H3;3-5,8-9H,6-7,12H2,1-2H3;3-5,7H,6,10H2,1-2H3;4-7H,1-3H3;3-5,7,11H,6H2,1-2H3;4-7H,1-3H3;3-8H,1-2H3;3-4,6H,5H2,1-2H3;3-6H,1-2H3,(H2,9,10);3-7H,1-2H3;3-7H,1-2H3;4H,1-3H3;2*3-5H,1-2H3
InChIKeyJAMFTTBRQGMGJA-UHFFFAOYSA-N
MW2769.98 g/mol
LogP39.56
Rot. Bonds34

About cumene;N,N-dimethyl-1-(4-propan-2-yl-2-pyridinyl)methanamine;2-methoxy-5-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;2-methyl-4-propan-2-ylpyridine;1-(oxan-4-yl)-3-propan-2-ylpyrrole;1-oxido-4-propan-2-ylpyridin-1-ium;2-piperidin-1-yl-4-propan-2-ylpyridine;2-propan-2-yl-1,3-oxazole;2-(3-propan-2-ylphenoxy)ethanamine;N'-(3-propan-2-ylphenyl)ethane-1,2-diamine;4-propan-2-ylpyridin-2-amine;2-propan-2-ylpyridine;(4-propan-2-yl-2-pyridinyl)methanamine;(4-propan-2-yl-2-pyridinyl)methanol;1-(4-propan-2-yl-2-pyridinyl)propan-2-one;2-propan-2-yl-1,3-thiazole;3-propan-2-yl-1-(2,2,2-trifluoroethyl)pyrazole

cumene;N,N-dimethyl-1-(4-propan-2-yl-2-pyridinyl)methanamine;2-methoxy-5-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;2-methyl-4-propan-2-ylpyridine;1-(oxan-4-yl)-3-propan-2-ylpyrrole;1-oxido-4-propan-2-ylpyridin-1-ium;2-piperidin-1-yl-4-propan-2-ylpyridine;2-propan-2-yl-1,3-oxazole;2-(3-propan-2-ylphenoxy)ethanamine;N'-(3-propan-2-ylphenyl)ethane-1,2-diamine;4-propan-2-ylpyridin-2-amine;2-propan-2-ylpyridine;(4-propan-2-yl-2-pyridinyl)methanamine;(4-propan-2-yl-2-pyridinyl)methanol;1-(4-propan-2-yl-2-pyridinyl)propan-2-one;2-propan-2-yl-1,3-thiazole;3-propan-2-yl-1-(2,2,2-trifluoroethyl)pyrazole (PubChem CID 158859543) has the molecular formula C164H245F3N24O8S and a molecular weight of 2769.98 g/mol. Its IUPAC name is cumene;N,N-dimethyl-1-(4-propan-2-yl-2-pyridinyl)methanamine;2-methoxy-5-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;2-methyl-4-propan-2-ylpyridine;1-(oxan-4-yl)-3-propan-2-ylpyrrole;1-oxido-4-propan-2-ylpyridin-1-ium;2-piperidin-1-yl-4-propan-2-ylpyridine;2-propan-2-yl-1,3-oxazole;2-(3-propan-2-ylphenoxy)ethanamine;N'-(3-propan-2-ylphenyl)ethane-1,2-diamine;4-propan-2-ylpyridin-2-amine;2-propan-2-ylpyridine;(4-propan-2-yl-2-pyridinyl)methanamine;(4-propan-2-yl-2-pyridinyl)methanol;1-(4-propan-2-yl-2-pyridinyl)propan-2-one;2-propan-2-yl-1,3-thiazole;3-propan-2-yl-1-(2,2,2-trifluoroethyl)pyrazole.

Molecular Properties

Compound Namecumene;N,N-dimethyl-1-(4-propan-2-yl-2-pyridinyl)methanamine;2-methoxy-5-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;2-methyl-4-propan-2-ylpyridine;1-(oxan-4-yl)-3-propan-2-ylpyrrole;1-oxido-4-propan-2-ylpyridin-1-ium;2-piperidin-1-yl-4-propan-2-ylpyridine;2-propan-2-yl-1,3-oxazole;2-(3-propan-2-ylphenoxy)ethanamine;N'-(3-propan-2-ylphenyl)ethane-1,2-diamine;4-propan-2-ylpyridin-2-amine;2-propan-2-ylpyridine;(4-propan-2-yl-2-pyridinyl)methanamine;(4-propan-2-yl-2-pyridinyl)methanol;1-(4-propan-2-yl-2-pyridinyl)propan-2-one;2-propan-2-yl-1,3-thiazole;3-propan-2-yl-1-(2,2,2-trifluoroethyl)pyrazole
PubChem CID158859543
Molecular FormulaC164H245F3N24O8S
Molecular Weight2769.98 g/mol
Exact Mass2767.92
IUPAC Namecumene;N,N-dimethyl-1-(4-propan-2-yl-2-pyridinyl)methanamine;2-methoxy-5-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;2-methyl-4-propan-2-ylpyridine;1-(oxan-4-yl)-3-propan-2-ylpyrrole;1-oxido-4-propan-2-ylpyridin-1-ium;2-piperidin-1-yl-4-propan-2-ylpyridine;2-propan-2-yl-1,3-oxazole;2-(3-propan-2-ylphenoxy)ethanamine;N'-(3-propan-2-ylphenyl)ethane-1,2-diamine;4-propan-2-ylpyridin-2-amine;2-propan-2-ylpyridine;(4-propan-2-yl-2-pyridinyl)methanamine;(4-propan-2-yl-2-pyridinyl)methanol;1-(4-propan-2-yl-2-pyridinyl)propan-2-one;2-propan-2-yl-1,3-thiazole;3-propan-2-yl-1-(2,2,2-trifluoroethyl)pyrazole
SMILESCC(=O)Cc1cc(C(C)C)ccn1.CC(C)c1cc[n+]([O-])cc1.CC(C)c1cccc(NCCN)c1.CC(C)c1cccc(OCCN)c1.CC(C)c1ccccc1.CC(C)c1ccccn1.CC(C)c1ccn(C2CCOCC2)c1.CC(C)c1ccn(CC(F)(F)F)n1.CC(C)c1ccnc(CN(C)C)c1.CC(C)c1ccnc(CN)c1.CC(C)c1ccnc(CO)c1.CC(C)c1ccnc(N)c1.CC(C)c1ccnc(N2CCCCC2)c1.CC(C)c1ncco1.CC(C)c1nccs1.COc1ccc(C(C)C)cn1.Cc1cc(C(C)C)ccn1.Cc1nnc(C(C)C)o1
InChIInChI=1S/C13H20N2.C12H19NO.2C11H18N2.C11H15NO.C11H17NO.C9H14N2.2C9H13NO.C9H13N.C9H12.C8H11F3N2.C8H12N2.C8H11NO.C8H11N.C6H10N2O.C6H9NO.C6H9NS/c1-11(2)12-6-7-14-13(10-12)15-8-4-3-5-9-15;1-10(2)11-3-6-13(9-11)12-4-7-14-8-5-12;1-9(2)10-5-6-12-11(7-10)8-13(3)4;1-9(2)10-4-3-5-11(8-10)13-7-6-12;1-8(2)10-4-5-12-11(7-10)6-9(3)13;1-9(2)10-4-3-5-11(8-10)13-7-6-12;1-7(2)8-3-4-11-9(5-8)6-10;1-7(2)8-4-5-9(11-3)10-6-8;1-7(2)8-3-4-10-9(5-8)6-11;1-7(2)9-4-5-10-8(3)6-9;1-8(2)9-6-4-3-5-7-9;1-6(2)7-3-4-13(12-7)5-8(9,10)11;1-6(2)7-3-4-10-8(9)5-7;1-7(2)8-3-5-9(10)6-4-8;1-7(2)8-5-3-4-6-9-8;1-4(2)6-8-7-5(3)9-6;2*1-5(2)6-7-3-4-8-6/h6-7,10-11H,3-5,8-9H2,1-2H3;3,6,9-10,12H,4-5,7-8H2,1-2H3;5-7,9H,8H2,1-4H3;3-5,8-9,13H,6-7,12H2,1-2H3;4-5,7-8H,6H2,1-3H3;3-5,8-9H,6-7,12H2,1-2H3;3-5,7H,6,10H2,1-2H3;4-7H,1-3H3;3-5,7,11H,6H2,1-2H3;4-7H,1-3H3;3-8H,1-2H3;3-4,6H,5H2,1-2H3;3-6H,1-2H3,(H2,9,10);3-7H,1-2H3;3-7H,1-2H3;4H,1-3H3;2*3-5H,1-2H3
InChIKeyJAMFTTBRQGMGJA-UHFFFAOYSA-N
XLogP39.56
TPSA431.12 Ų
H-Bond Donors6
H-Bond Acceptors32
Rotatable Bonds34
Heavy Atoms200
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002769.98
LogP ≤ 539.56
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1032

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N_oxide', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Analyze cumene;N,N-dimethyl-1-(4-propan-2-yl-2-pyridinyl)methanamine;2-methoxy-5-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;2-methyl-4-propan-2-ylpyridine;1-(oxan-4-yl)-3-propan-2-ylpyrrole;1-oxido-4-propan-2-ylpyridin-1-ium;2-piperidin-1-yl-4-propan-2-ylpyridine;2-propan-2-yl-1,3-oxazole;2-(3-propan-2-ylphenoxy)ethanamine;N'-(3-propan-2-ylphenyl)ethane-1,2-diamine;4-propan-2-ylpyridin-2-amine;2-propan-2-ylpyridine;(4-propan-2-yl-2-pyridinyl)methanamine;(4-propan-2-yl-2-pyridinyl)methanol;1-(4-propan-2-yl-2-pyridinyl)propan-2-one;2-propan-2-yl-1,3-thiazole;3-propan-2-yl-1-(2,2,2-trifluoroethyl)pyrazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of cumene;N,N-dimethyl-1-(4-propan-2-yl-2-pyridinyl)methanamine;2-methoxy-5-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;2-methyl-4-propan-2-ylpyridine;1-(oxan-4-yl)-3-propan-2-ylpyrrole;1-oxido-4-propan-2-ylpyridin-1-ium;2-piperidin-1-yl-4-propan-2-ylpyridine;2-propan-2-yl-1,3-oxazole;2-(3-propan-2-ylphenoxy)ethanamine;N'-(3-propan-2-ylphenyl)ethane-1,2-diamine;4-propan-2-ylpyridin-2-amine;2-propan-2-ylpyridine;(4-propan-2-yl-2-pyridinyl)methanamine;(4-propan-2-yl-2-pyridinyl)methanol;1-(4-propan-2-yl-2-pyridinyl)propan-2-one;2-propan-2-yl-1,3-thiazole;3-propan-2-yl-1-(2,2,2-trifluoroethyl)pyrazole?
The IUPAC name of cumene;N,N-dimethyl-1-(4-propan-2-yl-2-pyridinyl)methanamine;2-methoxy-5-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;2-methyl-4-propan-2-ylpyridine;1-(oxan-4-yl)-3-propan-2-ylpyrrole;1-oxido-4-propan-2-ylpyridin-1-ium;2-piperidin-1-yl-4-propan-2-ylpyridine;2-propan-2-yl-1,3-oxazole;2-(3-propan-2-ylphenoxy)ethanamine;N'-(3-propan-2-ylphenyl)ethane-1,2-diamine;4-propan-2-ylpyridin-2-amine;2-propan-2-ylpyridine;(4-propan-2-yl-2-pyridinyl)methanamine;(4-propan-2-yl-2-pyridinyl)methanol;1-(4-propan-2-yl-2-pyridinyl)propan-2-one;2-propan-2-yl-1,3-thiazole;3-propan-2-yl-1-(2,2,2-trifluoroethyl)pyrazole (CID 158859543) is cumene;N,N-dimethyl-1-(4-propan-2-yl-2-pyridinyl)methanamine;2-methoxy-5-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;2-methyl-4-propan-2-ylpyridine;1-(oxan-4-yl)-3-propan-2-ylpyrrole;1-oxido-4-propan-2-ylpyridin-1-ium;2-piperidin-1-yl-4-propan-2-ylpyridine;2-propan-2-yl-1,3-oxazole;2-(3-propan-2-ylphenoxy)ethanamine;N'-(3-propan-2-ylphenyl)ethane-1,2-diamine;4-propan-2-ylpyridin-2-amine;2-propan-2-ylpyridine;(4-propan-2-yl-2-pyridinyl)methanamine;(4-propan-2-yl-2-pyridinyl)methanol;1-(4-propan-2-yl-2-pyridinyl)propan-2-one;2-propan-2-yl-1,3-thiazole;3-propan-2-yl-1-(2,2,2-trifluoroethyl)pyrazole.
What is the SMILES notation for cumene;N,N-dimethyl-1-(4-propan-2-yl-2-pyridinyl)methanamine;2-methoxy-5-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;2-methyl-4-propan-2-ylpyridine;1-(oxan-4-yl)-3-propan-2-ylpyrrole;1-oxido-4-propan-2-ylpyridin-1-ium;2-piperidin-1-yl-4-propan-2-ylpyridine;2-propan-2-yl-1,3-oxazole;2-(3-propan-2-ylphenoxy)ethanamine;N'-(3-propan-2-ylphenyl)ethane-1,2-diamine;4-propan-2-ylpyridin-2-amine;2-propan-2-ylpyridine;(4-propan-2-yl-2-pyridinyl)methanamine;(4-propan-2-yl-2-pyridinyl)methanol;1-(4-propan-2-yl-2-pyridinyl)propan-2-one;2-propan-2-yl-1,3-thiazole;3-propan-2-yl-1-(2,2,2-trifluoroethyl)pyrazole?
The canonical SMILES for cumene;N,N-dimethyl-1-(4-propan-2-yl-2-pyridinyl)methanamine;2-methoxy-5-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;2-methyl-4-propan-2-ylpyridine;1-(oxan-4-yl)-3-propan-2-ylpyrrole;1-oxido-4-propan-2-ylpyridin-1-ium;2-piperidin-1-yl-4-propan-2-ylpyridine;2-propan-2-yl-1,3-oxazole;2-(3-propan-2-ylphenoxy)ethanamine;N'-(3-propan-2-ylphenyl)ethane-1,2-diamine;4-propan-2-ylpyridin-2-amine;2-propan-2-ylpyridine;(4-propan-2-yl-2-pyridinyl)methanamine;(4-propan-2-yl-2-pyridinyl)methanol;1-(4-propan-2-yl-2-pyridinyl)propan-2-one;2-propan-2-yl-1,3-thiazole;3-propan-2-yl-1-(2,2,2-trifluoroethyl)pyrazole is CC(=O)Cc1cc(C(C)C)ccn1.CC(C)c1cc[n+]([O-])cc1.CC(C)c1cccc(NCCN)c1.CC(C)c1cccc(OCCN)c1.CC(C)c1ccccc1.CC(C)c1ccccn1.CC(C)c1ccn(C2CCOCC2)c1.CC(C)c1ccn(CC(F)(F)F)n1.CC(C)c1ccnc(CN(C)C)c1.CC(C)c1ccnc(CN)c1.CC(C)c1ccnc(CO)c1.CC(C)c1ccnc(N)c1.CC(C)c1ccnc(N2CCCCC2)c1.CC(C)c1ncco1.CC(C)c1nccs1.COc1ccc(C(C)C)cn1.Cc1cc(C(C)C)ccn1.Cc1nnc(C(C)C)o1.
What is the InChIKey of cumene;N,N-dimethyl-1-(4-propan-2-yl-2-pyridinyl)methanamine;2-methoxy-5-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;2-methyl-4-propan-2-ylpyridine;1-(oxan-4-yl)-3-propan-2-ylpyrrole;1-oxido-4-propan-2-ylpyridin-1-ium;2-piperidin-1-yl-4-propan-2-ylpyridine;2-propan-2-yl-1,3-oxazole;2-(3-propan-2-ylphenoxy)ethanamine;N'-(3-propan-2-ylphenyl)ethane-1,2-diamine;4-propan-2-ylpyridin-2-amine;2-propan-2-ylpyridine;(4-propan-2-yl-2-pyridinyl)methanamine;(4-propan-2-yl-2-pyridinyl)methanol;1-(4-propan-2-yl-2-pyridinyl)propan-2-one;2-propan-2-yl-1,3-thiazole;3-propan-2-yl-1-(2,2,2-trifluoroethyl)pyrazole?
The InChIKey is JAMFTTBRQGMGJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2.C12H19NO.2C11H18N2.C11H15NO.C11H17NO.C9H14N2.2C9H13NO.C9H13N.C9H12.C8H11F3N2.C8H12N2.C8H11NO.C8H11N.C6H10N2O.C6H9NO.C6H9NS/c1-11(2)12-6-7-14-13(10-12)15-8-4-3-5-9-15;1-10(2)11-3-6-13(9-11)12-4-7-14-8-5-12;1-9(2)10-5-6-12-11(7-10)8-13(3)4;1-9(2)10-4-3-5-11(8-10)13-7-6-12;1-8(2)10-4-5-12-11(7-10)6-9(3)13;1-9(2)10-4-3-5-11(8-10)13-7-6-12;1-7(2)8-3-4-11-9(5-8)6-10;1-7(2)8-4-5-9(11-3)10-6-8;1-7(2)8-3-4-10-9(5-8)6-11;1-7(2)9-4-5-10-8(3)6-9;1-8(2)9-6-4-3-5-7-9;1-6(2)7-3-4-13(12-7)5-8(9,10)11;1-6(2)7-3-4-10-8(9)5-7;1-7(2)8-3-5-9(10)6-4-8;1-7(2)8-5-3-4-6-9-8;1-4(2)6-8-7-5(3)9-6;2*1-5(2)6-7-3-4-8-6/h6-7,10-11H,3-5,8-9H2,1-2H3;3,6,9-10,12H,4-5,7-8H2,1-2H3;5-7,9H,8H2,1-4H3;3-5,8-9,13H,6-7,12H2,1-2H3;4-5,7-8H,6H2,1-3H3;3-5,8-9H,6-7,12H2,1-2H3;3-5,7H,6,10H2,1-2H3;4-7H,1-3H3;3-5,7,11H,6H2,1-2H3;4-7H,1-3H3;3-8H,1-2H3;3-4,6H,5H2,1-2H3;3-6H,1-2H3,(H2,9,10);3-7H,1-2H3;3-7H,1-2H3;4H,1-3H3;2*3-5H,1-2H3.
What are the key properties of cumene;N,N-dimethyl-1-(4-propan-2-yl-2-pyridinyl)methanamine;2-methoxy-5-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;2-methyl-4-propan-2-ylpyridine;1-(oxan-4-yl)-3-propan-2-ylpyrrole;1-oxido-4-propan-2-ylpyridin-1-ium;2-piperidin-1-yl-4-propan-2-ylpyridine;2-propan-2-yl-1,3-oxazole;2-(3-propan-2-ylphenoxy)ethanamine;N'-(3-propan-2-ylphenyl)ethane-1,2-diamine;4-propan-2-ylpyridin-2-amine;2-propan-2-ylpyridine;(4-propan-2-yl-2-pyridinyl)methanamine;(4-propan-2-yl-2-pyridinyl)methanol;1-(4-propan-2-yl-2-pyridinyl)propan-2-one;2-propan-2-yl-1,3-thiazole;3-propan-2-yl-1-(2,2,2-trifluoroethyl)pyrazole?
cumene;N,N-dimethyl-1-(4-propan-2-yl-2-pyridinyl)methanamine;2-methoxy-5-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;2-methyl-4-propan-2-ylpyridine;1-(oxan-4-yl)-3-propan-2-ylpyrrole;1-oxido-4-propan-2-ylpyridin-1-ium;2-piperidin-1-yl-4-propan-2-ylpyridine;2-propan-2-yl-1,3-oxazole;2-(3-propan-2-ylphenoxy)ethanamine;N'-(3-propan-2-ylphenyl)ethane-1,2-diamine;4-propan-2-ylpyridin-2-amine;2-propan-2-ylpyridine;(4-propan-2-yl-2-pyridinyl)methanamine;(4-propan-2-yl-2-pyridinyl)methanol;1-(4-propan-2-yl-2-pyridinyl)propan-2-one;2-propan-2-yl-1,3-thiazole;3-propan-2-yl-1-(2,2,2-trifluoroethyl)pyrazole has a molecular weight of 2769.98 g/mol, XLogP of 39.56, 34 rotatable bonds, 6 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for cumene;N,N-dimethyl-1-(4-propan-2-yl-2-pyridinyl)methanamine;2-methoxy-5-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;2-methyl-4-propan-2-ylpyridine;1-(oxan-4-yl)-3-propan-2-ylpyrrole;1-oxido-4-propan-2-ylpyridin-1-ium;2-piperidin-1-yl-4-propan-2-ylpyridine;2-propan-2-yl-1,3-oxazole;2-(3-propan-2-ylphenoxy)ethanamine;N'-(3-propan-2-ylphenyl)ethane-1,2-diamine;4-propan-2-ylpyridin-2-amine;2-propan-2-ylpyridine;(4-propan-2-yl-2-pyridinyl)methanamine;(4-propan-2-yl-2-pyridinyl)methanol;1-(4-propan-2-yl-2-pyridinyl)propan-2-one;2-propan-2-yl-1,3-thiazole;3-propan-2-yl-1-(2,2,2-trifluoroethyl)pyrazole is sourced from PubChem (CID 158859543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).