N-pentan-2-yl-4-(propylamino)pyridine-2-carboxamide

C14H23N3O — CID 62185598

IUPACN-pentan-2-yl-4-(propylamino)pyridine-2-carboxamide
SMILESCCCNc1ccnc(C(=O)NC(C)CCC)c1
InChIInChI=1S/C14H23N3O/c1-4-6-11(3)17-14(18)13-10-12(7-9-16-13)15-8-5-2/h7,9-11H,4-6,8H2,1-3H3,(H,15,16)(H,17,18)
InChIKeyUSZAPYZEBZEMSQ-UHFFFAOYSA-N
MW249.36 g/mol
LogP2.82
Rot. Bonds7

About N-pentan-2-yl-4-(propylamino)pyridine-2-carboxamide

N-pentan-2-yl-4-(propylamino)pyridine-2-carboxamide (PubChem CID 62185598) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is N-pentan-2-yl-4-(propylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-pentan-2-yl-4-(propylamino)pyridine-2-carboxamide
PubChem CID62185598
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC NameN-pentan-2-yl-4-(propylamino)pyridine-2-carboxamide
SMILESCCCNc1ccnc(C(=O)NC(C)CCC)c1
InChIInChI=1S/C14H23N3O/c1-4-6-11(3)17-14(18)13-10-12(7-9-16-13)15-8-5-2/h7,9-11H,4-6,8H2,1-3H3,(H,15,16)(H,17,18)
InChIKeyUSZAPYZEBZEMSQ-UHFFFAOYSA-N
XLogP2.82
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 52.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-butan-2-yl-4-(butylamino)pyridine-2-carboxamide
CID 109202657
N-butan-2-yl-4-(ethylamino)pyridine-2-carboxamide
CID 62171647
4-chloro-N-pentan-2-ylpyridine-2-carboxamide
CID 43087437
N-[4-(dimethylamino)butan-2-yl]-4-(ethylamino)pyridine-2-carboxamide
CID 55046863
N-[2-(dimethylamino)propyl]-4-(propylamino)pyridine-2-carboxamide
CID 55047383
N-butan-2-yl-4-(2-phenylethylamino)pyridine-2-carboxamide
CID 109203268
N-butan-2-yl-4-[3-(dimethylamino)propylamino]pyridine-2-carboxamide
CID 109203245
N-hexan-2-yl-4-hydrazinylpyridine-2-carboxamide
CID 62237642
N-[2,6-di(propan-2-yl)phenyl]-4-(propylamino)pyridine-2-carboxamide
CID 109201269
4-(propylamino)-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide
CID 62172967
N-(2-propan-2-ylphenyl)-4-(propylamino)pyridine-2-carboxamide
CID 109201226
N-(3,4-dimethylphenyl)-4-(propylamino)pyridine-2-carboxamide
CID 62173356

Frequently Asked Questions

What is the IUPAC name of N-pentan-2-yl-4-(propylamino)pyridine-2-carboxamide?
The IUPAC name of N-pentan-2-yl-4-(propylamino)pyridine-2-carboxamide (CID 62185598) is N-pentan-2-yl-4-(propylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-pentan-2-yl-4-(propylamino)pyridine-2-carboxamide?
The canonical SMILES for N-pentan-2-yl-4-(propylamino)pyridine-2-carboxamide is CCCNc1ccnc(C(=O)NC(C)CCC)c1.
What is the InChIKey of N-pentan-2-yl-4-(propylamino)pyridine-2-carboxamide?
The InChIKey is USZAPYZEBZEMSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-4-6-11(3)17-14(18)13-10-12(7-9-16-13)15-8-5-2/h7,9-11H,4-6,8H2,1-3H3,(H,15,16)(H,17,18).
What are the key properties of N-pentan-2-yl-4-(propylamino)pyridine-2-carboxamide?
N-pentan-2-yl-4-(propylamino)pyridine-2-carboxamide has a molecular weight of 249.36 g/mol, XLogP of 2.82, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-pentan-2-yl-4-(propylamino)pyridine-2-carboxamide is sourced from PubChem (CID 62185598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).