N-cyclopropyl-3-(3-methylpiperidine-1-carbonyl)benzamide

C17H22N2O2 — CID 109050747

IUPACN-cyclopropyl-3-(3-methylpiperidine-1-carbonyl)benzamide
SMILESCC1CCCN(C(=O)c2cccc(C(=O)NC3CC3)c2)C1
InChIInChI=1S/C17H22N2O2/c1-12-4-3-9-19(11-12)17(21)14-6-2-5-13(10-14)16(20)18-15-7-8-15/h2,5-6,10,12,15H,3-4,7-9,11H2,1H3,(H,18,20)
InChIKeyBGIRLHIPYHCRHM-UHFFFAOYSA-N
MW286.37 g/mol
LogP2.45
Rot. Bonds3

About N-cyclopropyl-3-(3-methylpiperidine-1-carbonyl)benzamide

N-cyclopropyl-3-(3-methylpiperidine-1-carbonyl)benzamide (PubChem CID 109050747) has the molecular formula C17H22N2O2 and a molecular weight of 286.37 g/mol. Its IUPAC name is N-cyclopropyl-3-(3-methylpiperidine-1-carbonyl)benzamide.

Molecular Properties

Compound NameN-cyclopropyl-3-(3-methylpiperidine-1-carbonyl)benzamide
PubChem CID109050747
Molecular FormulaC17H22N2O2
Molecular Weight286.37 g/mol
Exact Mass286.17
IUPAC NameN-cyclopropyl-3-(3-methylpiperidine-1-carbonyl)benzamide
SMILESCC1CCCN(C(=O)c2cccc(C(=O)NC3CC3)c2)C1
InChIInChI=1S/C17H22N2O2/c1-12-4-3-9-19(11-12)17(21)14-6-2-5-13(10-14)16(20)18-15-7-8-15/h2,5-6,10,12,15H,3-4,7-9,11H2,1H3,(H,18,20)
InChIKeyBGIRLHIPYHCRHM-UHFFFAOYSA-N
XLogP2.45
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.37
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[3-(3-methylpiperidine-1-carbonyl)phenyl]-piperidin-1-ylmethanone
CID 109052035
N-cycloheptyl-3-(pyrrolidine-1-carbonyl)benzamide
CID 109051684
N-(2,6-difluorophenyl)-3-(3-methylpiperidine-1-carbonyl)benzamide
CID 109056590
(3-methylphenyl)-(3-methylpiperidin-1-yl)methanone
CID 3113385
N-cyclopentyl-4-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxamide
CID 109080925
3-(3-methylpiperidine-1-carbonyl)-N-(3-phenylpropyl)benzamide
CID 109055941
N-cycloheptyl-4-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxamide
CID 109089437
N-[2-(4-fluorophenyl)ethyl]-3-(3-methylpiperidine-1-carbonyl)benzamide
CID 109055423
N-(2,5-dichlorophenyl)-3-(3-methylpiperidine-1-carbonyl)benzamide
CID 109056580
(3R)-N-[5-(cyclopropylcarbamoyl)-2-methylphenyl]-3-methylpiperidine-1-carboxamide
CID 94161618
(3-methylpiperidin-1-yl)-[3-(trifluoromethyl)phenyl]methanone
CID 78783825
N-[3-(3-methylpiperidine-1-carbonyl)phenyl]cyclopropanecarboxamide
CID 51149495

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-(3-methylpiperidine-1-carbonyl)benzamide?
The IUPAC name of N-cyclopropyl-3-(3-methylpiperidine-1-carbonyl)benzamide (CID 109050747) is N-cyclopropyl-3-(3-methylpiperidine-1-carbonyl)benzamide.
What is the SMILES notation for N-cyclopropyl-3-(3-methylpiperidine-1-carbonyl)benzamide?
The canonical SMILES for N-cyclopropyl-3-(3-methylpiperidine-1-carbonyl)benzamide is CC1CCCN(C(=O)c2cccc(C(=O)NC3CC3)c2)C1.
What is the InChIKey of N-cyclopropyl-3-(3-methylpiperidine-1-carbonyl)benzamide?
The InChIKey is BGIRLHIPYHCRHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O2/c1-12-4-3-9-19(11-12)17(21)14-6-2-5-13(10-14)16(20)18-15-7-8-15/h2,5-6,10,12,15H,3-4,7-9,11H2,1H3,(H,18,20).
What are the key properties of N-cyclopropyl-3-(3-methylpiperidine-1-carbonyl)benzamide?
N-cyclopropyl-3-(3-methylpiperidine-1-carbonyl)benzamide has a molecular weight of 286.37 g/mol, XLogP of 2.45, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-(3-methylpiperidine-1-carbonyl)benzamide is sourced from PubChem (CID 109050747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).