4-(cyclopropylamino)-N-(2,3-dimethylphenyl)pyridine-2-carboxamide

C17H19N3O — CID 109201977

IUPAC4-(cyclopropylamino)-N-(2,3-dimethylphenyl)pyridine-2-carboxamide
SMILESCc1cccc(NC(=O)c2cc(NC3CC3)ccn2)c1C
InChIInChI=1S/C17H19N3O/c1-11-4-3-5-15(12(11)2)20-17(21)16-10-14(8-9-18-16)19-13-6-7-13/h3-5,8-10,13H,6-7H2,1-2H3,(H,18,19)(H,20,21)
InChIKeyJBZREPLPLKWQMN-UHFFFAOYSA-N
MW281.36 g/mol
LogP3.53
Rot. Bonds4

About 4-(cyclopropylamino)-N-(2,3-dimethylphenyl)pyridine-2-carboxamide

4-(cyclopropylamino)-N-(2,3-dimethylphenyl)pyridine-2-carboxamide (PubChem CID 109201977) has the molecular formula C17H19N3O and a molecular weight of 281.36 g/mol. Its IUPAC name is 4-(cyclopropylamino)-N-(2,3-dimethylphenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name4-(cyclopropylamino)-N-(2,3-dimethylphenyl)pyridine-2-carboxamide
PubChem CID109201977
Molecular FormulaC17H19N3O
Molecular Weight281.36 g/mol
Exact Mass281.15
IUPAC Name4-(cyclopropylamino)-N-(2,3-dimethylphenyl)pyridine-2-carboxamide
SMILESCc1cccc(NC(=O)c2cc(NC3CC3)ccn2)c1C
InChIInChI=1S/C17H19N3O/c1-11-4-3-5-15(12(11)2)20-17(21)16-10-14(8-9-18-16)19-13-6-7-13/h3-5,8-10,13H,6-7H2,1-2H3,(H,18,19)(H,20,21)
InChIKeyJBZREPLPLKWQMN-UHFFFAOYSA-N
XLogP3.53
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 53.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-bromophenyl)-4-(cyclopropylamino)pyridine-2-carboxamide
CID 109202038
N-(3-acetamidophenyl)-4-(cyclopropylamino)pyridine-2-carboxamide
CID 109202020
5-(cycloheptylamino)-N-(2,3-dimethylphenyl)pyridine-2-carboxamide
CID 109195369
4-N-cycloheptyl-2-N-(2,3-dimethylphenyl)pyridine-2,4-dicarboxamide
CID 109089379
4-(cyclohexylamino)-N-(2,3-dichlorophenyl)pyridine-2-carboxamide
CID 109205054
N-cyclopentyl-4-(2,3-dimethylanilino)pyridine-2-carboxamide
CID 109204081
4-amino-N-(2,3-dimethylphenyl)pyridine-2-carboxamide
CID 62156095
5-(cyclopropylamino)-N-(2,3-dimethylphenyl)pyrazine-2-carboxamide
CID 109271849
N-(2-chlorophenyl)-4-(cyclohexylamino)pyridine-2-carboxamide
CID 109204995
N-(2,3-dimethylphenyl)-4-(pyridin-4-ylmethylamino)pyridine-2-carboxamide
CID 109213435
4-(cycloheptylamino)-N-(2-ethoxyphenyl)pyridine-2-carboxamide
CID 109217163
2-N-(2,3-dimethylphenyl)-4-N-(2,6-dimethylphenyl)pyridine-2,4-dicarboxamide
CID 109092030

Frequently Asked Questions

What is the IUPAC name of 4-(cyclopropylamino)-N-(2,3-dimethylphenyl)pyridine-2-carboxamide?
The IUPAC name of 4-(cyclopropylamino)-N-(2,3-dimethylphenyl)pyridine-2-carboxamide (CID 109201977) is 4-(cyclopropylamino)-N-(2,3-dimethylphenyl)pyridine-2-carboxamide.
What is the SMILES notation for 4-(cyclopropylamino)-N-(2,3-dimethylphenyl)pyridine-2-carboxamide?
The canonical SMILES for 4-(cyclopropylamino)-N-(2,3-dimethylphenyl)pyridine-2-carboxamide is Cc1cccc(NC(=O)c2cc(NC3CC3)ccn2)c1C.
What is the InChIKey of 4-(cyclopropylamino)-N-(2,3-dimethylphenyl)pyridine-2-carboxamide?
The InChIKey is JBZREPLPLKWQMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O/c1-11-4-3-5-15(12(11)2)20-17(21)16-10-14(8-9-18-16)19-13-6-7-13/h3-5,8-10,13H,6-7H2,1-2H3,(H,18,19)(H,20,21).
What are the key properties of 4-(cyclopropylamino)-N-(2,3-dimethylphenyl)pyridine-2-carboxamide?
4-(cyclopropylamino)-N-(2,3-dimethylphenyl)pyridine-2-carboxamide has a molecular weight of 281.36 g/mol, XLogP of 3.53, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclopropylamino)-N-(2,3-dimethylphenyl)pyridine-2-carboxamide is sourced from PubChem (CID 109201977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).