N-cycloheptyl-4-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxamide

C20H29N3O2 — CID 109089437

IUPACN-cycloheptyl-4-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxamide
SMILESCC1CCCN(C(=O)c2ccnc(C(=O)NC3CCCCCC3)c2)C1
InChIInChI=1S/C20H29N3O2/c1-15-7-6-12-23(14-15)20(25)16-10-11-21-18(13-16)19(24)22-17-8-4-2-3-5-9-17/h10-11,13,15,17H,2-9,12,14H2,1H3,(H,22,24)
InChIKeyFWZNPGBTPCGVPV-UHFFFAOYSA-N
MW343.47 g/mol
LogP3.41
Rot. Bonds3

About N-cycloheptyl-4-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxamide

N-cycloheptyl-4-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxamide (PubChem CID 109089437) has the molecular formula C20H29N3O2 and a molecular weight of 343.47 g/mol. Its IUPAC name is N-cycloheptyl-4-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-cycloheptyl-4-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxamide
PubChem CID109089437
Molecular FormulaC20H29N3O2
Molecular Weight343.47 g/mol
Exact Mass343.23
IUPAC NameN-cycloheptyl-4-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxamide
SMILESCC1CCCN(C(=O)c2ccnc(C(=O)NC3CCCCCC3)c2)C1
InChIInChI=1S/C20H29N3O2/c1-15-7-6-12-23(14-15)20(25)16-10-11-21-18(13-16)19(24)22-17-8-4-2-3-5-9-17/h10-11,13,15,17H,2-9,12,14H2,1H3,(H,22,24)
InChIKeyFWZNPGBTPCGVPV-UHFFFAOYSA-N
XLogP3.41
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.47
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopentyl-4-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxamide
CID 109080925
N-cyclohexyl-4-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide
CID 109080315
4-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxylic acid
CID 112700608
N-[2-(dimethylamino)ethyl]-4-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxamide
CID 109083608
4-(3-methylpiperidine-1-carbonyl)-N-(1-phenylethyl)pyridine-2-carboxamide
CID 109086112
N-cyclopentyl-2-(4-methylpiperidine-1-carbonyl)pyridine-4-carboxamide
CID 109080690
2-[(4-methylcycloheptyl)carbamoyl]pyridine-4-carboxylic acid
CID 122056326
N-cyclopropyl-3-(3-methylpiperidine-1-carbonyl)benzamide
CID 109050747
N-[(4-fluorophenyl)methyl]-4-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxamide
CID 109086578
4-(3-methylpiperidine-1-carbonyl)-N-[4-(trifluoromethyl)phenyl]pyridine-2-carboxamide
CID 109090330
N-(4-chloro-2-methylphenyl)-4-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxamide
CID 109090311
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxamide
CID 109090343

Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-4-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxamide?
The IUPAC name of N-cycloheptyl-4-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxamide (CID 109089437) is N-cycloheptyl-4-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxamide.
What is the SMILES notation for N-cycloheptyl-4-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxamide?
The canonical SMILES for N-cycloheptyl-4-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxamide is CC1CCCN(C(=O)c2ccnc(C(=O)NC3CCCCCC3)c2)C1.
What is the InChIKey of N-cycloheptyl-4-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxamide?
The InChIKey is FWZNPGBTPCGVPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H29N3O2/c1-15-7-6-12-23(14-15)20(25)16-10-11-21-18(13-16)19(24)22-17-8-4-2-3-5-9-17/h10-11,13,15,17H,2-9,12,14H2,1H3,(H,22,24).
What are the key properties of N-cycloheptyl-4-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxamide?
N-cycloheptyl-4-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxamide has a molecular weight of 343.47 g/mol, XLogP of 3.41, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-4-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxamide is sourced from PubChem (CID 109089437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).