N-cyclopentyl-6-(cyclopentylamino)pyridin-1-ium-3-carboxamide

C16H24N3O+ — CID 7130484

IUPACN-cyclopentyl-6-(cyclopentylamino)pyridin-1-ium-3-carboxamide
SMILESO=C(NC1CCCC1)c1ccc(NC2CCCC2)[nH+]c1
InChIInChI=1S/C16H23N3O/c20-16(19-14-7-3-4-8-14)12-9-10-15(17-11-12)18-13-5-1-2-6-13/h9-11,13-14H,1-8H2,(H,17,18)(H,19,20)/p+1
InChIKeyPYWKCSYMUCQMJO-UHFFFAOYSA-O
MW274.39 g/mol
LogP2.53
Rot. Bonds4

About N-cyclopentyl-6-(cyclopentylamino)pyridin-1-ium-3-carboxamide

N-cyclopentyl-6-(cyclopentylamino)pyridin-1-ium-3-carboxamide (PubChem CID 7130484) has the molecular formula C16H24N3O+ and a molecular weight of 274.39 g/mol. Its IUPAC name is N-cyclopentyl-6-(cyclopentylamino)pyridin-1-ium-3-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-6-(cyclopentylamino)pyridin-1-ium-3-carboxamide
PubChem CID7130484
Molecular FormulaC16H24N3O+
Molecular Weight274.39 g/mol
Exact Mass274.19
IUPAC NameN-cyclopentyl-6-(cyclopentylamino)pyridin-1-ium-3-carboxamide
SMILESO=C(NC1CCCC1)c1ccc(NC2CCCC2)[nH+]c1
InChIInChI=1S/C16H23N3O/c20-16(19-14-7-3-4-8-14)12-9-10-15(17-11-12)18-13-5-1-2-6-13/h9-11,13-14H,1-8H2,(H,17,18)(H,19,20)/p+1
InChIKeyPYWKCSYMUCQMJO-UHFFFAOYSA-O
XLogP2.53
TPSA55.27 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.39
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-cyclopentyl-6-(cyclopentylamino)pyridin-1-ium-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-cyclopentyl-4-sulfanylbenzamide
CID 71194494
6-(cyclohexylamino)-N-cyclopropylpyridine-3-carboxamide
CID 25473351
4-bromo-N-cycloheptylbenzamide
CID 2843132
4-bromo-N-cyclooctylbenzamide
CID 902872
N-cyclooctyl-4-methylbenzamide
CID 3995245
N-cyclopentyl-3,4-dihydroxybenzamide
CID 113199189
4-amino-N-cyclohexylbenzamide;hydrochloride
CID 83814043
N-cyclopentyl-4-(hydroxymethyl)benzamide
CID 60636896
N-cyclohexyl-4-(cyclohexylamino)-3-nitrobenzamide
CID 2959407
N-cyclododecyl-4-nitrobenzamide
CID 19168070
N-cyclopentylpyridine-4-carboxamide
CID 4212000
N-cyclobutyl-4-methylbenzamide
CID 23530676

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-6-(cyclopentylamino)pyridin-1-ium-3-carboxamide?
The IUPAC name of N-cyclopentyl-6-(cyclopentylamino)pyridin-1-ium-3-carboxamide (CID 7130484) is N-cyclopentyl-6-(cyclopentylamino)pyridin-1-ium-3-carboxamide.
What is the SMILES notation for N-cyclopentyl-6-(cyclopentylamino)pyridin-1-ium-3-carboxamide?
The canonical SMILES for N-cyclopentyl-6-(cyclopentylamino)pyridin-1-ium-3-carboxamide is O=C(NC1CCCC1)c1ccc(NC2CCCC2)[nH+]c1.
What is the InChIKey of N-cyclopentyl-6-(cyclopentylamino)pyridin-1-ium-3-carboxamide?
The InChIKey is PYWKCSYMUCQMJO-UHFFFAOYSA-O. The full InChI is InChI=1S/C16H23N3O/c20-16(19-14-7-3-4-8-14)12-9-10-15(17-11-12)18-13-5-1-2-6-13/h9-11,13-14H,1-8H2,(H,17,18)(H,19,20)/p+1.
What are the key properties of N-cyclopentyl-6-(cyclopentylamino)pyridin-1-ium-3-carboxamide?
N-cyclopentyl-6-(cyclopentylamino)pyridin-1-ium-3-carboxamide has a molecular weight of 274.39 g/mol, XLogP of 2.53, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-6-(cyclopentylamino)pyridin-1-ium-3-carboxamide is sourced from PubChem (CID 7130484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).