N-(2-bromophenyl)-4-(cyclopropylamino)pyridine-2-carboxamide

C15H14BrN3O — CID 109202038

IUPACN-(2-bromophenyl)-4-(cyclopropylamino)pyridine-2-carboxamide
SMILESO=C(Nc1ccccc1Br)c1cc(NC2CC2)ccn1
InChIInChI=1S/C15H14BrN3O/c16-12-3-1-2-4-13(12)19-15(20)14-9-11(7-8-17-14)18-10-5-6-10/h1-4,7-10H,5-6H2,(H,17,18)(H,19,20)
InChIKeyUCOPQVUFNXZFKW-UHFFFAOYSA-N
MW332.20 g/mol
LogP3.67
Rot. Bonds4

About N-(2-bromophenyl)-4-(cyclopropylamino)pyridine-2-carboxamide

N-(2-bromophenyl)-4-(cyclopropylamino)pyridine-2-carboxamide (PubChem CID 109202038) has the molecular formula C15H14BrN3O and a molecular weight of 332.20 g/mol. Its IUPAC name is N-(2-bromophenyl)-4-(cyclopropylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2-bromophenyl)-4-(cyclopropylamino)pyridine-2-carboxamide
PubChem CID109202038
Molecular FormulaC15H14BrN3O
Molecular Weight332.20 g/mol
Exact Mass331.03
IUPAC NameN-(2-bromophenyl)-4-(cyclopropylamino)pyridine-2-carboxamide
SMILESO=C(Nc1ccccc1Br)c1cc(NC2CC2)ccn1
InChIInChI=1S/C15H14BrN3O/c16-12-3-1-2-4-13(12)19-15(20)14-9-11(7-8-17-14)18-10-5-6-10/h1-4,7-10H,5-6H2,(H,17,18)(H,19,20)
InChIKeyUCOPQVUFNXZFKW-UHFFFAOYSA-N
XLogP3.67
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.20
LogP ≤ 53.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-chlorophenyl)-4-(cyclohexylamino)pyridine-2-carboxamide
CID 109204995
4-(cyclopropylamino)-N-(2,3-dimethylphenyl)pyridine-2-carboxamide
CID 109201977
N-(2-bromophenyl)-4-(2-fluoroanilino)pyridine-2-carboxamide
CID 109220697
4-(cyclohexylamino)-N-(2,3-dichlorophenyl)pyridine-2-carboxamide
CID 109205054
4-(cycloheptylamino)-N-(2-ethoxyphenyl)pyridine-2-carboxamide
CID 109217163
N-(3-acetamidophenyl)-4-(cyclopropylamino)pyridine-2-carboxamide
CID 109202020
N-(4-bromophenyl)-4-(cycloheptylamino)pyridine-2-carboxamide
CID 109217159
4-(cyclopentylamino)-N-(2,3,4-trifluorophenyl)pyridine-2-carboxamide
CID 109204356
N-(2-bromophenyl)-4-[(4-methylphenyl)methylamino]pyridine-2-carboxamide
CID 109210613
N-(2-bromophenyl)-4-[(2-methylphenyl)methylamino]pyridine-2-carboxamide
CID 109210139
4-(cyclopropylamino)-N-(4-propan-2-ylphenyl)pyridine-2-carboxamide
CID 109201983
N-[(2-chlorophenyl)methyl]-4-(cyclopropylamino)pyridine-2-carboxamide
CID 109201907

Frequently Asked Questions

What is the IUPAC name of N-(2-bromophenyl)-4-(cyclopropylamino)pyridine-2-carboxamide?
The IUPAC name of N-(2-bromophenyl)-4-(cyclopropylamino)pyridine-2-carboxamide (CID 109202038) is N-(2-bromophenyl)-4-(cyclopropylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-(2-bromophenyl)-4-(cyclopropylamino)pyridine-2-carboxamide?
The canonical SMILES for N-(2-bromophenyl)-4-(cyclopropylamino)pyridine-2-carboxamide is O=C(Nc1ccccc1Br)c1cc(NC2CC2)ccn1.
What is the InChIKey of N-(2-bromophenyl)-4-(cyclopropylamino)pyridine-2-carboxamide?
The InChIKey is UCOPQVUFNXZFKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14BrN3O/c16-12-3-1-2-4-13(12)19-15(20)14-9-11(7-8-17-14)18-10-5-6-10/h1-4,7-10H,5-6H2,(H,17,18)(H,19,20).
What are the key properties of N-(2-bromophenyl)-4-(cyclopropylamino)pyridine-2-carboxamide?
N-(2-bromophenyl)-4-(cyclopropylamino)pyridine-2-carboxamide has a molecular weight of 332.20 g/mol, XLogP of 3.67, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromophenyl)-4-(cyclopropylamino)pyridine-2-carboxamide is sourced from PubChem (CID 109202038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).