4-[[2-(2-bromophenyl)cyclopropyl]amino]pyridine-3-carboxamide

C15H14BrN3O — CID 133470272

IUPAC4-[[2-(2-bromophenyl)cyclopropyl]amino]pyridine-3-carboxamide
SMILESNC(=O)c1cnccc1NC1CC1c1ccccc1Br
InChIInChI=1S/C15H14BrN3O/c16-12-4-2-1-3-9(12)10-7-14(10)19-13-5-6-18-8-11(13)15(17)20/h1-6,8,10,14H,7H2,(H2,17,20)(H,18,19)
InChIKeyFHYLWSUVBFMNLI-UHFFFAOYSA-N
MW332.20 g/mol
LogP2.91
Rot. Bonds4

About 4-[[2-(2-bromophenyl)cyclopropyl]amino]pyridine-3-carboxamide

4-[[2-(2-bromophenyl)cyclopropyl]amino]pyridine-3-carboxamide (PubChem CID 133470272) has the molecular formula C15H14BrN3O and a molecular weight of 332.20 g/mol. Its IUPAC name is 4-[[2-(2-bromophenyl)cyclopropyl]amino]pyridine-3-carboxamide.

Molecular Properties

Compound Name4-[[2-(2-bromophenyl)cyclopropyl]amino]pyridine-3-carboxamide
PubChem CID133470272
Molecular FormulaC15H14BrN3O
Molecular Weight332.20 g/mol
Exact Mass331.03
IUPAC Name4-[[2-(2-bromophenyl)cyclopropyl]amino]pyridine-3-carboxamide
SMILESNC(=O)c1cnccc1NC1CC1c1ccccc1Br
InChIInChI=1S/C15H14BrN3O/c16-12-4-2-1-3-9(12)10-7-14(10)19-13-5-6-18-8-11(13)15(17)20/h1-6,8,10,14H,7H2,(H2,17,20)(H,18,19)
InChIKeyFHYLWSUVBFMNLI-UHFFFAOYSA-N
XLogP2.91
TPSA68.01 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 ≤ 52.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(2-phenylcyclopropyl)amino]pyridine-4-carbothioamide
CID 114288410
N-[(1R,2S)-2-(2-bromophenyl)cyclopropyl]-2-(4-methylphenyl)acetamide
CID 166359384
4-[(5-chloro-2,3-dihydro-1H-inden-1-yl)amino]pyridine-3-carboxamide
CID 133468614
3-bromopyridine-4-carboxamide;hydrochloride
CID 169006653
N-[(1R,2S)-2-(2-bromophenyl)cyclopropyl]-4-methylbenzamide
CID 100649749
4-(3-methylanilino)pyridine-3-carboxamide
CID 69304920
4-[(3-methyloxetan-3-yl)amino]pyridine-3-carboxamide
CID 154029220
cis-(1S,2S)-2-(2-bromophenyl)cyclopropan-1-amine
CID 93299622
2-[(2-aminocyclopropyl)amino]-6-bromobenzamide
CID 114884697
4-[[1-(2,4-difluorophenyl)pyrrolidin-3-yl]amino]pyridine-3-carboxamide
CID 75478044
4-[[(3S)-1-(2,4-difluorophenyl)pyrrolidin-3-yl]amino]pyridine-3-carboxamide
CID 97307055
4-[1-(2,3-dimethylphenyl)ethylamino]pyridine-3-carboxamide
CID 133471329

Frequently Asked Questions

What is the IUPAC name of 4-[[2-(2-bromophenyl)cyclopropyl]amino]pyridine-3-carboxamide?
The IUPAC name of 4-[[2-(2-bromophenyl)cyclopropyl]amino]pyridine-3-carboxamide (CID 133470272) is 4-[[2-(2-bromophenyl)cyclopropyl]amino]pyridine-3-carboxamide.
What is the SMILES notation for 4-[[2-(2-bromophenyl)cyclopropyl]amino]pyridine-3-carboxamide?
The canonical SMILES for 4-[[2-(2-bromophenyl)cyclopropyl]amino]pyridine-3-carboxamide is NC(=O)c1cnccc1NC1CC1c1ccccc1Br.
What is the InChIKey of 4-[[2-(2-bromophenyl)cyclopropyl]amino]pyridine-3-carboxamide?
The InChIKey is FHYLWSUVBFMNLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14BrN3O/c16-12-4-2-1-3-9(12)10-7-14(10)19-13-5-6-18-8-11(13)15(17)20/h1-6,8,10,14H,7H2,(H2,17,20)(H,18,19).
What are the key properties of 4-[[2-(2-bromophenyl)cyclopropyl]amino]pyridine-3-carboxamide?
4-[[2-(2-bromophenyl)cyclopropyl]amino]pyridine-3-carboxamide has a molecular weight of 332.20 g/mol, XLogP of 2.91, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-(2-bromophenyl)cyclopropyl]amino]pyridine-3-carboxamide is sourced from PubChem (CID 133470272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).