5-(cyclopropylamino)-N-(4-propan-2-ylphenyl)pyridine-2-carboxamide

C18H21N3O — CID 109180137

IUPAC5-(cyclopropylamino)-N-(4-propan-2-ylphenyl)pyridine-2-carboxamide
SMILESCC(C)c1ccc(NC(=O)c2ccc(NC3CC3)cn2)cc1
InChIInChI=1S/C18H21N3O/c1-12(2)13-3-5-15(6-4-13)21-18(22)17-10-9-16(11-19-17)20-14-7-8-14/h3-6,9-12,14,20H,7-8H2,1-2H3,(H,21,22)
InChIKeyGIHRZRPRWBFPLY-UHFFFAOYSA-N
MW295.39 g/mol
LogP4.03
Rot. Bonds5

About 5-(cyclopropylamino)-N-(4-propan-2-ylphenyl)pyridine-2-carboxamide

5-(cyclopropylamino)-N-(4-propan-2-ylphenyl)pyridine-2-carboxamide (PubChem CID 109180137) has the molecular formula C18H21N3O and a molecular weight of 295.39 g/mol. Its IUPAC name is 5-(cyclopropylamino)-N-(4-propan-2-ylphenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-(cyclopropylamino)-N-(4-propan-2-ylphenyl)pyridine-2-carboxamide
PubChem CID109180137
Molecular FormulaC18H21N3O
Molecular Weight295.39 g/mol
Exact Mass295.17
IUPAC Name5-(cyclopropylamino)-N-(4-propan-2-ylphenyl)pyridine-2-carboxamide
SMILESCC(C)c1ccc(NC(=O)c2ccc(NC3CC3)cn2)cc1
InChIInChI=1S/C18H21N3O/c1-12(2)13-3-5-15(6-4-13)21-18(22)17-10-9-16(11-19-17)20-14-7-8-14/h3-6,9-12,14,20H,7-8H2,1-2H3,(H,21,22)
InChIKeyGIHRZRPRWBFPLY-UHFFFAOYSA-N
XLogP4.03
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.39
LogP ≤ 54.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 5-(cyclopropylamino)-N-(4-propan-2-ylphenyl)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

5-[(1,1-dioxothiolan-3-yl)amino]-N-(4-propan-2-ylphenyl)pyridine-2-carboxamide
CID 109193159
4-(cyclopropylamino)-N-(4-propan-2-ylphenyl)pyridine-2-carboxamide
CID 109201983
N-(4-tert-butylphenyl)-5-(cyclopentylamino)pyridine-2-carboxamide
CID 109182449
5-(cyclohexylamino)-N-propan-2-ylpyridine-2-carboxamide
CID 109179444
5-(cyclohexylamino)-N-phenylpyridine-2-carboxamide
CID 109183141
N-(3-acetamidophenyl)-5-(cyclopropylamino)pyridine-2-carboxamide
CID 109180174
2-(cyclopropylamino)-6-methyl-N-(4-propan-2-ylphenyl)pyrimidine-4-carboxamide
CID 109319750
5-(cyclopropylamino)-N-(4-phenoxyphenyl)pyridine-2-carboxamide
CID 109180189
5-(cyclopentylamino)-N-(3,5-dimethylphenyl)pyridine-2-carboxamide
CID 109182436
5-(cyclohexylamino)-N-(3,4-dichlorophenyl)pyridine-2-carboxamide
CID 109183218
2-(cycloheptylamino)-N-(4-propan-2-ylphenyl)pyrimidine-5-carboxamide
CID 109263206
5-(cyclohexylamino)-N-cyclopropylpyridine-2-carboxamide
CID 109179840

Frequently Asked Questions

What is the IUPAC name of 5-(cyclopropylamino)-N-(4-propan-2-ylphenyl)pyridine-2-carboxamide?
The IUPAC name of 5-(cyclopropylamino)-N-(4-propan-2-ylphenyl)pyridine-2-carboxamide (CID 109180137) is 5-(cyclopropylamino)-N-(4-propan-2-ylphenyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-(cyclopropylamino)-N-(4-propan-2-ylphenyl)pyridine-2-carboxamide?
The canonical SMILES for 5-(cyclopropylamino)-N-(4-propan-2-ylphenyl)pyridine-2-carboxamide is CC(C)c1ccc(NC(=O)c2ccc(NC3CC3)cn2)cc1.
What is the InChIKey of 5-(cyclopropylamino)-N-(4-propan-2-ylphenyl)pyridine-2-carboxamide?
The InChIKey is GIHRZRPRWBFPLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O/c1-12(2)13-3-5-15(6-4-13)21-18(22)17-10-9-16(11-19-17)20-14-7-8-14/h3-6,9-12,14,20H,7-8H2,1-2H3,(H,21,22).
What are the key properties of 5-(cyclopropylamino)-N-(4-propan-2-ylphenyl)pyridine-2-carboxamide?
5-(cyclopropylamino)-N-(4-propan-2-ylphenyl)pyridine-2-carboxamide has a molecular weight of 295.39 g/mol, XLogP of 4.03, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(cyclopropylamino)-N-(4-propan-2-ylphenyl)pyridine-2-carboxamide is sourced from PubChem (CID 109180137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).