N-cyclopropyl-4-[(4-methylphenyl)methylamino]pyridine-2-carboxamide

C17H19N3O — CID 109201706

IUPACN-cyclopropyl-4-[(4-methylphenyl)methylamino]pyridine-2-carboxamide
SMILESCc1ccc(CNc2ccnc(C(=O)NC3CC3)c2)cc1
InChIInChI=1S/C17H19N3O/c1-12-2-4-13(5-3-12)11-19-15-8-9-18-16(10-15)17(21)20-14-6-7-14/h2-5,8-10,14H,6-7,11H2,1H3,(H,18,19)(H,20,21)
InChIKeyOOWYWRRPQCPEGH-UHFFFAOYSA-N
MW281.36 g/mol
LogP2.89
Rot. Bonds5

About N-cyclopropyl-4-[(4-methylphenyl)methylamino]pyridine-2-carboxamide

N-cyclopropyl-4-[(4-methylphenyl)methylamino]pyridine-2-carboxamide (PubChem CID 109201706) has the molecular formula C17H19N3O and a molecular weight of 281.36 g/mol. Its IUPAC name is N-cyclopropyl-4-[(4-methylphenyl)methylamino]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-4-[(4-methylphenyl)methylamino]pyridine-2-carboxamide
PubChem CID109201706
Molecular FormulaC17H19N3O
Molecular Weight281.36 g/mol
Exact Mass281.15
IUPAC NameN-cyclopropyl-4-[(4-methylphenyl)methylamino]pyridine-2-carboxamide
SMILESCc1ccc(CNc2ccnc(C(=O)NC3CC3)c2)cc1
InChIInChI=1S/C17H19N3O/c1-12-2-4-13(5-3-12)11-19-15-8-9-18-16(10-15)17(21)20-14-6-7-14/h2-5,8-10,14H,6-7,11H2,1H3,(H,18,19)(H,20,21)
InChIKeyOOWYWRRPQCPEGH-UHFFFAOYSA-N
XLogP2.89
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclohexyl-4-[(4-methoxyphenyl)methylamino]pyridine-2-carboxamide
CID 109204760
N-cyclohexyl-4-[(3,4-dimethoxyphenyl)methylamino]pyridine-2-carboxamide
CID 109204782
N-cyclopropyl-4-(furan-2-ylmethylamino)pyridine-2-carboxamide
CID 109201702
N-cyclohexyl-4-(ethylamino)pyridine-2-carboxamide
CID 62171612
N-cyclopropyl-4-(3-methoxypropylamino)pyridine-2-carboxamide
CID 109201692
N-(4-ethylcyclohexyl)-4-(propylamino)pyridine-2-carboxamide
CID 63498977
N-[(2-methylphenyl)methyl]-4-[(4-methylphenyl)methylamino]pyridine-2-carboxamide
CID 109209919
N-(2-bromophenyl)-4-[(4-methylphenyl)methylamino]pyridine-2-carboxamide
CID 109210613
4-[(4-chlorophenyl)methylamino]-N-(2,5-dimethylphenyl)pyridine-2-carboxamide
CID 109211894
N-(3-chloro-2-methylphenyl)-4-[(4-methylphenyl)methylamino]pyridine-2-carboxamide
CID 109210580
N-cyclopentyl-4-[2-(4-methoxyphenyl)ethylamino]pyridine-2-carboxamide
CID 109204026
N-cyclopropyl-4-[2-(4-sulfamoylphenyl)ethylamino]pyridine-2-carboxamide
CID 109201734

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-[(4-methylphenyl)methylamino]pyridine-2-carboxamide?
The IUPAC name of N-cyclopropyl-4-[(4-methylphenyl)methylamino]pyridine-2-carboxamide (CID 109201706) is N-cyclopropyl-4-[(4-methylphenyl)methylamino]pyridine-2-carboxamide.
What is the SMILES notation for N-cyclopropyl-4-[(4-methylphenyl)methylamino]pyridine-2-carboxamide?
The canonical SMILES for N-cyclopropyl-4-[(4-methylphenyl)methylamino]pyridine-2-carboxamide is Cc1ccc(CNc2ccnc(C(=O)NC3CC3)c2)cc1.
What is the InChIKey of N-cyclopropyl-4-[(4-methylphenyl)methylamino]pyridine-2-carboxamide?
The InChIKey is OOWYWRRPQCPEGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O/c1-12-2-4-13(5-3-12)11-19-15-8-9-18-16(10-15)17(21)20-14-6-7-14/h2-5,8-10,14H,6-7,11H2,1H3,(H,18,19)(H,20,21).
What are the key properties of N-cyclopropyl-4-[(4-methylphenyl)methylamino]pyridine-2-carboxamide?
N-cyclopropyl-4-[(4-methylphenyl)methylamino]pyridine-2-carboxamide has a molecular weight of 281.36 g/mol, XLogP of 2.89, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-[(4-methylphenyl)methylamino]pyridine-2-carboxamide is sourced from PubChem (CID 109201706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).