N-cyclopentyl-4-(2,4,6-trimethylanilino)pyridine-2-carboxamide

C20H25N3O — CID 109204088

IUPACN-cyclopentyl-4-(2,4,6-trimethylanilino)pyridine-2-carboxamide
SMILESCc1cc(C)c(Nc2ccnc(C(=O)NC3CCCC3)c2)c(C)c1
InChIInChI=1S/C20H25N3O/c1-13-10-14(2)19(15(3)11-13)22-17-8-9-21-18(12-17)20(24)23-16-6-4-5-7-16/h8-12,16H,4-7H2,1-3H3,(H,21,22)(H,23,24)
InChIKeyURLHGGUBZMZSOG-UHFFFAOYSA-N
MW323.44 g/mol
LogP4.42
Rot. Bonds4

About N-cyclopentyl-4-(2,4,6-trimethylanilino)pyridine-2-carboxamide

N-cyclopentyl-4-(2,4,6-trimethylanilino)pyridine-2-carboxamide (PubChem CID 109204088) has the molecular formula C20H25N3O and a molecular weight of 323.44 g/mol. Its IUPAC name is N-cyclopentyl-4-(2,4,6-trimethylanilino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-4-(2,4,6-trimethylanilino)pyridine-2-carboxamide
PubChem CID109204088
Molecular FormulaC20H25N3O
Molecular Weight323.44 g/mol
Exact Mass323.20
IUPAC NameN-cyclopentyl-4-(2,4,6-trimethylanilino)pyridine-2-carboxamide
SMILESCc1cc(C)c(Nc2ccnc(C(=O)NC3CCCC3)c2)c(C)c1
InChIInChI=1S/C20H25N3O/c1-13-10-14(2)19(15(3)11-13)22-17-8-9-21-18(12-17)20(24)23-16-6-4-5-7-16/h8-12,16H,4-7H2,1-3H3,(H,21,22)(H,23,24)
InChIKeyURLHGGUBZMZSOG-UHFFFAOYSA-N
XLogP4.42
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.44
LogP ≤ 54.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-cyclopentyl-4-(2,4,6-trimethylanilino)pyridine-2-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-(2-methylanilino)pyridine-2-carboxamide
CID 109204070
N-cyclopentyl-4-(2,3-dimethylanilino)pyridine-2-carboxamide
CID 109204081
N-tert-butyl-4-(2,4,6-trimethylanilino)pyridine-2-carboxamide
CID 109216858
4-(4-chloro-2-methylanilino)-N-cyclohexylpyridine-2-carboxamide
CID 109204837
4-(4-chloroanilino)-N-cyclopentylpyridine-2-carboxamide
CID 109204096
N-(2-chloro-4,6-dimethylphenyl)-4-(cyclopentylamino)pyridine-2-carboxamide
CID 109204288
N-cycloheptyl-4-hydrazinylpyridine-2-carboxamide
CID 62241897
4-(3-acetamidoanilino)-N-cycloheptylpyridine-2-carboxamide
CID 109217101
N-cyclohexyl-4-(ethylamino)pyridine-2-carboxamide
CID 62171612
4-(4-chloro-2-methoxy-5-methylanilino)-N-cyclopentylpyridine-2-carboxamide
CID 109204162
4-(4-chloro-2-methoxy-5-methylanilino)-N-cyclohexylpyridine-2-carboxamide
CID 109204886
4-(4-acetylanilino)-N-cyclopropylpyridine-2-carboxamide
CID 109201823

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-4-(2,4,6-trimethylanilino)pyridine-2-carboxamide?
The IUPAC name of N-cyclopentyl-4-(2,4,6-trimethylanilino)pyridine-2-carboxamide (CID 109204088) is N-cyclopentyl-4-(2,4,6-trimethylanilino)pyridine-2-carboxamide.
What is the SMILES notation for N-cyclopentyl-4-(2,4,6-trimethylanilino)pyridine-2-carboxamide?
The canonical SMILES for N-cyclopentyl-4-(2,4,6-trimethylanilino)pyridine-2-carboxamide is Cc1cc(C)c(Nc2ccnc(C(=O)NC3CCCC3)c2)c(C)c1.
What is the InChIKey of N-cyclopentyl-4-(2,4,6-trimethylanilino)pyridine-2-carboxamide?
The InChIKey is URLHGGUBZMZSOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O/c1-13-10-14(2)19(15(3)11-13)22-17-8-9-21-18(12-17)20(24)23-16-6-4-5-7-16/h8-12,16H,4-7H2,1-3H3,(H,21,22)(H,23,24).
What are the key properties of N-cyclopentyl-4-(2,4,6-trimethylanilino)pyridine-2-carboxamide?
N-cyclopentyl-4-(2,4,6-trimethylanilino)pyridine-2-carboxamide has a molecular weight of 323.44 g/mol, XLogP of 4.42, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-4-(2,4,6-trimethylanilino)pyridine-2-carboxamide is sourced from PubChem (CID 109204088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).