N-benzyl-N,1-dimethylpiperidine-4-carboxamide;N-benzyl-1-methylpiperidine-4-carboxamide;(4-chlorophenyl)-(1-methylpiperidin-4-yl)methanone;N,1-dimethyl-N-phenylpiperidine-4-carboxamide;1-(4-ethoxyphenyl)-4-methylpiperazine;1-methyl-N-phenylpiperidine-4-carboxamide;N-(1-methylpiperidin-4-yl)benzamide;N-(1-methylpiperidin-4-yl)-2-phenylacetamide;(1-methyl-4-pyridin-3-ylpiperidin-4-yl)-morpholin-4-ylmethanone;(1-methyl-4-pyridin-4-ylpiperidin-4-yl)-morpholin-4-ylmethanone;toluene

C148H208ClN21O12 — CID 158108688

IUPACN-benzyl-N,1-dimethylpiperidine-4-carboxamide;N-benzyl-1-methylpiperidine-4-carboxamide;(4-chlorophenyl)-(1-methylpiperidin-4-yl)methanone;N,1-dimethyl-N-phenylpiperidine-4-carboxamide;1-(4-ethoxyphenyl)-4-methylpiperazine;1-methyl-N-phenylpiperidine-4-carboxamide;N-(1-methylpiperidin-4-yl)benzamide;N-(1-methylpiperidin-4-yl)-2-phenylacetamide;(1-methyl-4-pyridin-3-ylpiperidin-4-yl)-morpholin-4-ylmethanone;(1-methyl-4-pyridin-4-ylpiperidin-4-yl)-morpholin-4-ylmethanone;toluene
SMILESCCOc1ccc(N2CCN(C)CC2)cc1.CN1CCC(C(=O)N(C)Cc2ccccc2)CC1.CN1CCC(C(=O)N(C)c2ccccc2)CC1.CN1CCC(C(=O)N2CCOCC2)(c2cccnc2)CC1.CN1CCC(C(=O)N2CCOCC2)(c2ccncc2)CC1.CN1CCC(C(=O)NCc2ccccc2)CC1.CN1CCC(C(=O)Nc2ccccc2)CC1.CN1CCC(C(=O)c2ccc(Cl)cc2)CC1.CN1CCC(NC(=O)Cc2ccccc2)CC1.CN1CCC(NC(=O)c2ccccc2)CC1.Cc1ccccc1
InChIInChI=1S/2C16H23N3O2.C15H22N2O.3C14H20N2O.C13H16ClNO.2C13H18N2O.C13H20N2O.C7H8/c1-18-8-4-16(5-9-18,14-2-6-17-7-3-14)15(20)19-10-12-21-13-11-19;1-18-7-4-16(5-8-18,14-3-2-6-17-13-14)15(20)19-9-11-21-12-10-19;1-16-10-8-14(9-11-16)15(18)17(2)12-13-6-4-3-5-7-13;1-15-10-8-12(9-11-15)14(17)16(2)13-6-4-3-5-7-13;1-16-9-7-13(8-10-16)14(17)15-11-12-5-3-2-4-6-12;1-16-9-7-13(8-10-16)15-14(17)11-12-5-3-2-4-6-12;1-15-8-6-11(7-9-15)13(16)10-2-4-12(14)5-3-10;1-15-9-7-11(8-10-15)13(16)14-12-5-3-2-4-6-12;1-15-9-7-12(8-10-15)14-13(16)11-5-3-2-4-6-11;1-3-16-13-6-4-12(5-7-13)15-10-8-14(2)9-11-15;1-7-5-3-2-4-6-7/h2-3,6-7H,4-5,8-13H2,1H3;2-3,6,13H,4-5,7-12H2,1H3;3-7,14H,8-12H2,1-2H3;3-7,12H,8-11H2,1-2H3;2*2-6,13H,7-11H2,1H3,(H,15,17);2-5,11H,6-9H2,1H3;2-6,11H,7-10H2,1H3,(H,14,16);2-6,12H,7-10H2,1H3,(H,14,16);4-7H,3,8-11H2,1-2H3;2-6H,1H3
InChIKeyFQDPCRPBJYAZOS-UHFFFAOYSA-N
MW2508.88 g/mol
LogP19.04
Rot. Bonds24

About N-benzyl-N,1-dimethylpiperidine-4-carboxamide;N-benzyl-1-methylpiperidine-4-carboxamide;(4-chlorophenyl)-(1-methylpiperidin-4-yl)methanone;N,1-dimethyl-N-phenylpiperidine-4-carboxamide;1-(4-ethoxyphenyl)-4-methylpiperazine;1-methyl-N-phenylpiperidine-4-carboxamide;N-(1-methylpiperidin-4-yl)benzamide;N-(1-methylpiperidin-4-yl)-2-phenylacetamide;(1-methyl-4-pyridin-3-ylpiperidin-4-yl)-morpholin-4-ylmethanone;(1-methyl-4-pyridin-4-ylpiperidin-4-yl)-morpholin-4-ylmethanone;toluene

N-benzyl-N,1-dimethylpiperidine-4-carboxamide;N-benzyl-1-methylpiperidine-4-carboxamide;(4-chlorophenyl)-(1-methylpiperidin-4-yl)methanone;N,1-dimethyl-N-phenylpiperidine-4-carboxamide;1-(4-ethoxyphenyl)-4-methylpiperazine;1-methyl-N-phenylpiperidine-4-carboxamide;N-(1-methylpiperidin-4-yl)benzamide;N-(1-methylpiperidin-4-yl)-2-phenylacetamide;(1-methyl-4-pyridin-3-ylpiperidin-4-yl)-morpholin-4-ylmethanone;(1-methyl-4-pyridin-4-ylpiperidin-4-yl)-morpholin-4-ylmethanone;toluene (PubChem CID 158108688) has the molecular formula C148H208ClN21O12 and a molecular weight of 2508.88 g/mol. Its IUPAC name is N-benzyl-N,1-dimethylpiperidine-4-carboxamide;N-benzyl-1-methylpiperidine-4-carboxamide;(4-chlorophenyl)-(1-methylpiperidin-4-yl)methanone;N,1-dimethyl-N-phenylpiperidine-4-carboxamide;1-(4-ethoxyphenyl)-4-methylpiperazine;1-methyl-N-phenylpiperidine-4-carboxamide;N-(1-methylpiperidin-4-yl)benzamide;N-(1-methylpiperidin-4-yl)-2-phenylacetamide;(1-methyl-4-pyridin-3-ylpiperidin-4-yl)-morpholin-4-ylmethanone;(1-methyl-4-pyridin-4-ylpiperidin-4-yl)-morpholin-4-ylmethanone;toluene.

Molecular Properties

Compound NameN-benzyl-N,1-dimethylpiperidine-4-carboxamide;N-benzyl-1-methylpiperidine-4-carboxamide;(4-chlorophenyl)-(1-methylpiperidin-4-yl)methanone;N,1-dimethyl-N-phenylpiperidine-4-carboxamide;1-(4-ethoxyphenyl)-4-methylpiperazine;1-methyl-N-phenylpiperidine-4-carboxamide;N-(1-methylpiperidin-4-yl)benzamide;N-(1-methylpiperidin-4-yl)-2-phenylacetamide;(1-methyl-4-pyridin-3-ylpiperidin-4-yl)-morpholin-4-ylmethanone;(1-methyl-4-pyridin-4-ylpiperidin-4-yl)-morpholin-4-ylmethanone;toluene
PubChem CID158108688
Molecular FormulaC148H208ClN21O12
Molecular Weight2508.88 g/mol
Exact Mass2506.60
IUPAC NameN-benzyl-N,1-dimethylpiperidine-4-carboxamide;N-benzyl-1-methylpiperidine-4-carboxamide;(4-chlorophenyl)-(1-methylpiperidin-4-yl)methanone;N,1-dimethyl-N-phenylpiperidine-4-carboxamide;1-(4-ethoxyphenyl)-4-methylpiperazine;1-methyl-N-phenylpiperidine-4-carboxamide;N-(1-methylpiperidin-4-yl)benzamide;N-(1-methylpiperidin-4-yl)-2-phenylacetamide;(1-methyl-4-pyridin-3-ylpiperidin-4-yl)-morpholin-4-ylmethanone;(1-methyl-4-pyridin-4-ylpiperidin-4-yl)-morpholin-4-ylmethanone;toluene
SMILESCCOc1ccc(N2CCN(C)CC2)cc1.CN1CCC(C(=O)N(C)Cc2ccccc2)CC1.CN1CCC(C(=O)N(C)c2ccccc2)CC1.CN1CCC(C(=O)N2CCOCC2)(c2cccnc2)CC1.CN1CCC(C(=O)N2CCOCC2)(c2ccncc2)CC1.CN1CCC(C(=O)NCc2ccccc2)CC1.CN1CCC(C(=O)Nc2ccccc2)CC1.CN1CCC(C(=O)c2ccc(Cl)cc2)CC1.CN1CCC(NC(=O)Cc2ccccc2)CC1.CN1CCC(NC(=O)c2ccccc2)CC1.Cc1ccccc1
InChIInChI=1S/2C16H23N3O2.C15H22N2O.3C14H20N2O.C13H16ClNO.2C13H18N2O.C13H20N2O.C7H8/c1-18-8-4-16(5-9-18,14-2-6-17-7-3-14)15(20)19-10-12-21-13-11-19;1-18-7-4-16(5-8-18,14-3-2-6-17-13-14)15(20)19-9-11-21-12-10-19;1-16-10-8-14(9-11-16)15(18)17(2)12-13-6-4-3-5-7-13;1-15-10-8-12(9-11-15)14(17)16(2)13-6-4-3-5-7-13;1-16-9-7-13(8-10-16)14(17)15-11-12-5-3-2-4-6-12;1-16-9-7-13(8-10-16)15-14(17)11-12-5-3-2-4-6-12;1-15-8-6-11(7-9-15)13(16)10-2-4-12(14)5-3-10;1-15-9-7-11(8-10-15)13(16)14-12-5-3-2-4-6-12;1-15-9-7-12(8-10-15)14-13(16)11-5-3-2-4-6-11;1-3-16-13-6-4-12(5-7-13)15-10-8-14(2)9-11-15;1-7-5-3-2-4-6-7/h2-3,6-7H,4-5,8-13H2,1H3;2-3,6,13H,4-5,7-12H2,1H3;3-7,14H,8-12H2,1-2H3;3-7,12H,8-11H2,1-2H3;2*2-6,13H,7-11H2,1H3,(H,15,17);2-5,11H,6-9H2,1H3;2-6,11H,7-10H2,1H3,(H,14,16);2-6,12H,7-10H2,1H3,(H,14,16);4-7H,3,8-11H2,1-2H3;2-6H,1H3
InChIKeyFQDPCRPBJYAZOS-UHFFFAOYSA-N
XLogP19.04
TPSA303.82 Ų
H-Bond Donors4
H-Bond Acceptors25
Rotatable Bonds24
Heavy Atoms182
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002508.88
LogP ≤ 519.04
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1025

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

Analyze N-benzyl-N,1-dimethylpiperidine-4-carboxamide;N-benzyl-1-methylpiperidine-4-carboxamide;(4-chlorophenyl)-(1-methylpiperidin-4-yl)methanone;N,1-dimethyl-N-phenylpiperidine-4-carboxamide;1-(4-ethoxyphenyl)-4-methylpiperazine;1-methyl-N-phenylpiperidine-4-carboxamide;N-(1-methylpiperidin-4-yl)benzamide;N-(1-methylpiperidin-4-yl)-2-phenylacetamide;(1-methyl-4-pyridin-3-ylpiperidin-4-yl)-morpholin-4-ylmethanone;(1-methyl-4-pyridin-4-ylpiperidin-4-yl)-morpholin-4-ylmethanone;toluene with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-N,1-dimethylpiperidine-4-carboxamide;N-benzyl-1-methylpiperidine-4-carboxamide;(4-chlorophenyl)-(1-methylpiperidin-4-yl)methanone;N,1-dimethyl-N-phenylpiperidine-4-carboxamide;1-(4-ethoxyphenyl)-4-methylpiperazine;1-methyl-N-phenylpiperidine-4-carboxamide;N-(1-methylpiperidin-4-yl)benzamide;N-(1-methylpiperidin-4-yl)-2-phenylacetamide;(1-methyl-4-pyridin-3-ylpiperidin-4-yl)-morpholin-4-ylmethanone;(1-methyl-4-pyridin-4-ylpiperidin-4-yl)-morpholin-4-ylmethanone;toluene?
The IUPAC name of N-benzyl-N,1-dimethylpiperidine-4-carboxamide;N-benzyl-1-methylpiperidine-4-carboxamide;(4-chlorophenyl)-(1-methylpiperidin-4-yl)methanone;N,1-dimethyl-N-phenylpiperidine-4-carboxamide;1-(4-ethoxyphenyl)-4-methylpiperazine;1-methyl-N-phenylpiperidine-4-carboxamide;N-(1-methylpiperidin-4-yl)benzamide;N-(1-methylpiperidin-4-yl)-2-phenylacetamide;(1-methyl-4-pyridin-3-ylpiperidin-4-yl)-morpholin-4-ylmethanone;(1-methyl-4-pyridin-4-ylpiperidin-4-yl)-morpholin-4-ylmethanone;toluene (CID 158108688) is N-benzyl-N,1-dimethylpiperidine-4-carboxamide;N-benzyl-1-methylpiperidine-4-carboxamide;(4-chlorophenyl)-(1-methylpiperidin-4-yl)methanone;N,1-dimethyl-N-phenylpiperidine-4-carboxamide;1-(4-ethoxyphenyl)-4-methylpiperazine;1-methyl-N-phenylpiperidine-4-carboxamide;N-(1-methylpiperidin-4-yl)benzamide;N-(1-methylpiperidin-4-yl)-2-phenylacetamide;(1-methyl-4-pyridin-3-ylpiperidin-4-yl)-morpholin-4-ylmethanone;(1-methyl-4-pyridin-4-ylpiperidin-4-yl)-morpholin-4-ylmethanone;toluene.
What is the SMILES notation for N-benzyl-N,1-dimethylpiperidine-4-carboxamide;N-benzyl-1-methylpiperidine-4-carboxamide;(4-chlorophenyl)-(1-methylpiperidin-4-yl)methanone;N,1-dimethyl-N-phenylpiperidine-4-carboxamide;1-(4-ethoxyphenyl)-4-methylpiperazine;1-methyl-N-phenylpiperidine-4-carboxamide;N-(1-methylpiperidin-4-yl)benzamide;N-(1-methylpiperidin-4-yl)-2-phenylacetamide;(1-methyl-4-pyridin-3-ylpiperidin-4-yl)-morpholin-4-ylmethanone;(1-methyl-4-pyridin-4-ylpiperidin-4-yl)-morpholin-4-ylmethanone;toluene?
The canonical SMILES for N-benzyl-N,1-dimethylpiperidine-4-carboxamide;N-benzyl-1-methylpiperidine-4-carboxamide;(4-chlorophenyl)-(1-methylpiperidin-4-yl)methanone;N,1-dimethyl-N-phenylpiperidine-4-carboxamide;1-(4-ethoxyphenyl)-4-methylpiperazine;1-methyl-N-phenylpiperidine-4-carboxamide;N-(1-methylpiperidin-4-yl)benzamide;N-(1-methylpiperidin-4-yl)-2-phenylacetamide;(1-methyl-4-pyridin-3-ylpiperidin-4-yl)-morpholin-4-ylmethanone;(1-methyl-4-pyridin-4-ylpiperidin-4-yl)-morpholin-4-ylmethanone;toluene is CCOc1ccc(N2CCN(C)CC2)cc1.CN1CCC(C(=O)N(C)Cc2ccccc2)CC1.CN1CCC(C(=O)N(C)c2ccccc2)CC1.CN1CCC(C(=O)N2CCOCC2)(c2cccnc2)CC1.CN1CCC(C(=O)N2CCOCC2)(c2ccncc2)CC1.CN1CCC(C(=O)NCc2ccccc2)CC1.CN1CCC(C(=O)Nc2ccccc2)CC1.CN1CCC(C(=O)c2ccc(Cl)cc2)CC1.CN1CCC(NC(=O)Cc2ccccc2)CC1.CN1CCC(NC(=O)c2ccccc2)CC1.Cc1ccccc1.
What is the InChIKey of N-benzyl-N,1-dimethylpiperidine-4-carboxamide;N-benzyl-1-methylpiperidine-4-carboxamide;(4-chlorophenyl)-(1-methylpiperidin-4-yl)methanone;N,1-dimethyl-N-phenylpiperidine-4-carboxamide;1-(4-ethoxyphenyl)-4-methylpiperazine;1-methyl-N-phenylpiperidine-4-carboxamide;N-(1-methylpiperidin-4-yl)benzamide;N-(1-methylpiperidin-4-yl)-2-phenylacetamide;(1-methyl-4-pyridin-3-ylpiperidin-4-yl)-morpholin-4-ylmethanone;(1-methyl-4-pyridin-4-ylpiperidin-4-yl)-morpholin-4-ylmethanone;toluene?
The InChIKey is FQDPCRPBJYAZOS-UHFFFAOYSA-N. The full InChI is InChI=1S/2C16H23N3O2.C15H22N2O.3C14H20N2O.C13H16ClNO.2C13H18N2O.C13H20N2O.C7H8/c1-18-8-4-16(5-9-18,14-2-6-17-7-3-14)15(20)19-10-12-21-13-11-19;1-18-7-4-16(5-8-18,14-3-2-6-17-13-14)15(20)19-9-11-21-12-10-19;1-16-10-8-14(9-11-16)15(18)17(2)12-13-6-4-3-5-7-13;1-15-10-8-12(9-11-15)14(17)16(2)13-6-4-3-5-7-13;1-16-9-7-13(8-10-16)14(17)15-11-12-5-3-2-4-6-12;1-16-9-7-13(8-10-16)15-14(17)11-12-5-3-2-4-6-12;1-15-8-6-11(7-9-15)13(16)10-2-4-12(14)5-3-10;1-15-9-7-11(8-10-15)13(16)14-12-5-3-2-4-6-12;1-15-9-7-12(8-10-15)14-13(16)11-5-3-2-4-6-11;1-3-16-13-6-4-12(5-7-13)15-10-8-14(2)9-11-15;1-7-5-3-2-4-6-7/h2-3,6-7H,4-5,8-13H2,1H3;2-3,6,13H,4-5,7-12H2,1H3;3-7,14H,8-12H2,1-2H3;3-7,12H,8-11H2,1-2H3;2*2-6,13H,7-11H2,1H3,(H,15,17);2-5,11H,6-9H2,1H3;2-6,11H,7-10H2,1H3,(H,14,16);2-6,12H,7-10H2,1H3,(H,14,16);4-7H,3,8-11H2,1-2H3;2-6H,1H3.
What are the key properties of N-benzyl-N,1-dimethylpiperidine-4-carboxamide;N-benzyl-1-methylpiperidine-4-carboxamide;(4-chlorophenyl)-(1-methylpiperidin-4-yl)methanone;N,1-dimethyl-N-phenylpiperidine-4-carboxamide;1-(4-ethoxyphenyl)-4-methylpiperazine;1-methyl-N-phenylpiperidine-4-carboxamide;N-(1-methylpiperidin-4-yl)benzamide;N-(1-methylpiperidin-4-yl)-2-phenylacetamide;(1-methyl-4-pyridin-3-ylpiperidin-4-yl)-morpholin-4-ylmethanone;(1-methyl-4-pyridin-4-ylpiperidin-4-yl)-morpholin-4-ylmethanone;toluene?
N-benzyl-N,1-dimethylpiperidine-4-carboxamide;N-benzyl-1-methylpiperidine-4-carboxamide;(4-chlorophenyl)-(1-methylpiperidin-4-yl)methanone;N,1-dimethyl-N-phenylpiperidine-4-carboxamide;1-(4-ethoxyphenyl)-4-methylpiperazine;1-methyl-N-phenylpiperidine-4-carboxamide;N-(1-methylpiperidin-4-yl)benzamide;N-(1-methylpiperidin-4-yl)-2-phenylacetamide;(1-methyl-4-pyridin-3-ylpiperidin-4-yl)-morpholin-4-ylmethanone;(1-methyl-4-pyridin-4-ylpiperidin-4-yl)-morpholin-4-ylmethanone;toluene has a molecular weight of 2508.88 g/mol, XLogP of 19.04, 24 rotatable bonds, 4 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N,1-dimethylpiperidine-4-carboxamide;N-benzyl-1-methylpiperidine-4-carboxamide;(4-chlorophenyl)-(1-methylpiperidin-4-yl)methanone;N,1-dimethyl-N-phenylpiperidine-4-carboxamide;1-(4-ethoxyphenyl)-4-methylpiperazine;1-methyl-N-phenylpiperidine-4-carboxamide;N-(1-methylpiperidin-4-yl)benzamide;N-(1-methylpiperidin-4-yl)-2-phenylacetamide;(1-methyl-4-pyridin-3-ylpiperidin-4-yl)-morpholin-4-ylmethanone;(1-methyl-4-pyridin-4-ylpiperidin-4-yl)-morpholin-4-ylmethanone;toluene is sourced from PubChem (CID 158108688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).