3-methyl-N-(1-methylpiperidin-4-yl)-5-piperidin-4-ylbenzamide

C19H29N3O — CID 165436175

IUPAC3-methyl-N-(1-methylpiperidin-4-yl)-5-piperidin-4-ylbenzamide
SMILESCc1cc(C(=O)NC2CCN(C)CC2)cc(C2CCNCC2)c1
InChIInChI=1S/C19H29N3O/c1-14-11-16(15-3-7-20-8-4-15)13-17(12-14)19(23)21-18-5-9-22(2)10-6-18/h11-13,15,18,20H,3-10H2,1-2H3,(H,21,23)
InChIKeySYHNLZOURUSAQP-UHFFFAOYSA-N
MW315.46 g/mol
LogP2.29
Rot. Bonds3

About 3-methyl-N-(1-methylpiperidin-4-yl)-5-piperidin-4-ylbenzamide

3-methyl-N-(1-methylpiperidin-4-yl)-5-piperidin-4-ylbenzamide (PubChem CID 165436175) has the molecular formula C19H29N3O and a molecular weight of 315.46 g/mol. Its IUPAC name is 3-methyl-N-(1-methylpiperidin-4-yl)-5-piperidin-4-ylbenzamide.

Molecular Properties

Compound Name3-methyl-N-(1-methylpiperidin-4-yl)-5-piperidin-4-ylbenzamide
PubChem CID165436175
Molecular FormulaC19H29N3O
Molecular Weight315.46 g/mol
Exact Mass315.23
IUPAC Name3-methyl-N-(1-methylpiperidin-4-yl)-5-piperidin-4-ylbenzamide
SMILESCc1cc(C(=O)NC2CCN(C)CC2)cc(C2CCNCC2)c1
InChIInChI=1S/C19H29N3O/c1-14-11-16(15-3-7-20-8-4-15)13-17(12-14)19(23)21-18-5-9-22(2)10-6-18/h11-13,15,18,20H,3-10H2,1-2H3,(H,21,23)
InChIKeySYHNLZOURUSAQP-UHFFFAOYSA-N
XLogP2.29
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.46
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclohexyl-3-methyl-5-piperidin-4-ylbenzamide;hydrochloride
CID 165436170
3-methyl-N-(oxan-4-yl)-5-piperidin-4-ylbenzamide;hydrochloride
CID 165436172
N-(3,3-difluorocyclobutyl)-3-methyl-5-piperidin-4-ylbenzamide
CID 165436163
N-(3,3-difluorocyclobutyl)-3-methyl-5-piperidin-4-ylbenzamide;hydrochloride
CID 165436162
3-methyl-N-(oxolan-3-yl)-5-piperidin-4-ylbenzamide
CID 165436167
3-methyl-5-piperidin-4-ylbenzamide;hydrochloride
CID 165436136
3,5-diamino-N-(1-methylpiperidin-4-yl)benzamide
CID 61094399
3-bromo-5-methyl-N-(1-methylpyrrolidin-3-yl)benzamide
CID 104852532
ethane;5-methyl-N-(1-methylpiperidin-4-yl)thiophene-3-carboxamide
CID 145257142
(4-methoxypiperidin-1-yl)-(3-methyl-5-piperidin-4-ylphenyl)methanone
CID 165436191
(4,4-difluoropiperidin-1-yl)-(3-methyl-5-piperidin-4-ylphenyl)methanone
CID 165436193
N-cyclopropyl-3-piperidin-4-yl-5-(trifluoromethoxy)benzamide
CID 166176264

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(1-methylpiperidin-4-yl)-5-piperidin-4-ylbenzamide?
The IUPAC name of 3-methyl-N-(1-methylpiperidin-4-yl)-5-piperidin-4-ylbenzamide (CID 165436175) is 3-methyl-N-(1-methylpiperidin-4-yl)-5-piperidin-4-ylbenzamide.
What is the SMILES notation for 3-methyl-N-(1-methylpiperidin-4-yl)-5-piperidin-4-ylbenzamide?
The canonical SMILES for 3-methyl-N-(1-methylpiperidin-4-yl)-5-piperidin-4-ylbenzamide is Cc1cc(C(=O)NC2CCN(C)CC2)cc(C2CCNCC2)c1.
What is the InChIKey of 3-methyl-N-(1-methylpiperidin-4-yl)-5-piperidin-4-ylbenzamide?
The InChIKey is SYHNLZOURUSAQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N3O/c1-14-11-16(15-3-7-20-8-4-15)13-17(12-14)19(23)21-18-5-9-22(2)10-6-18/h11-13,15,18,20H,3-10H2,1-2H3,(H,21,23).
What are the key properties of 3-methyl-N-(1-methylpiperidin-4-yl)-5-piperidin-4-ylbenzamide?
3-methyl-N-(1-methylpiperidin-4-yl)-5-piperidin-4-ylbenzamide has a molecular weight of 315.46 g/mol, XLogP of 2.29, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(1-methylpiperidin-4-yl)-5-piperidin-4-ylbenzamide is sourced from PubChem (CID 165436175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).