2-amino-5-bromo-N-(4-chloropyrimidin-2-yl)pyridine-4-carboxamide

C10H7BrClN5O — CID 114194072

IUPAC2-amino-5-bromo-N-(4-chloropyrimidin-2-yl)pyridine-4-carboxamide
SMILESNc1cc(C(=O)Nc2nccc(Cl)n2)c(Br)cn1
InChIInChI=1S/C10H7BrClN5O/c11-6-4-15-8(13)3-5(6)9(18)17-10-14-2-1-7(12)16-10/h1-4H,(H2,13,15)(H,14,16,17,18)
InChIKeyJYWWFISQPCOYNR-UHFFFAOYSA-N
MW328.56 g/mol
LogP2.12
Rot. Bonds2

About 2-amino-5-bromo-N-(4-chloropyrimidin-2-yl)pyridine-4-carboxamide

2-amino-5-bromo-N-(4-chloropyrimidin-2-yl)pyridine-4-carboxamide (PubChem CID 114194072) has the molecular formula C10H7BrClN5O and a molecular weight of 328.56 g/mol. Its IUPAC name is 2-amino-5-bromo-N-(4-chloropyrimidin-2-yl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-5-bromo-N-(4-chloropyrimidin-2-yl)pyridine-4-carboxamide
PubChem CID114194072
Molecular FormulaC10H7BrClN5O
Molecular Weight328.56 g/mol
Exact Mass326.95
IUPAC Name2-amino-5-bromo-N-(4-chloropyrimidin-2-yl)pyridine-4-carboxamide
SMILESNc1cc(C(=O)Nc2nccc(Cl)n2)c(Br)cn1
InChIInChI=1S/C10H7BrClN5O/c11-6-4-15-8(13)3-5(6)9(18)17-10-14-2-1-7(12)16-10/h1-4H,(H2,13,15)(H,14,16,17,18)
InChIKeyJYWWFISQPCOYNR-UHFFFAOYSA-N
XLogP2.12
TPSA93.79 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.56
LogP ≤ 52.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-amino-5-bromo-N-(4-chloropyrimidin-2-yl)pyridine-4-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

2-amino-N-(5-bromo-6-methyl-2-pyridinyl)-5-chloropyridine-4-carboxamide
CID 114923983
5-amino-N-(4-chloropyrimidin-2-yl)pyridine-2-carboxamide
CID 114052185
4-chloro-N-(4-chloropyrimidin-2-yl)-2-methylbenzamide
CID 114052523
5,6-dichloro-N-(4-chloropyrimidin-2-yl)pyridine-3-carboxamide
CID 114052239
(4-chloropyrimidin-2-yl)carbamic acid
CID 135282743
2-chloro-N-(4-chloropyrimidin-2-yl)-6-methylpyridine-4-carboxamide
CID 114052237
2-amino-5-bromo-N-(1,3-dimethylpyrazol-4-yl)pyridine-4-carboxamide
CID 114194052
N-(6-amino-3-pyridinyl)-2-bromo-4-chlorobenzamide
CID 103806405
2-amino-5-bromo-N-(pyridazin-3-ylmethyl)pyridine-4-carboxamide
CID 114194058
2-amino-N-(5-amino-5-oxopentyl)-5-bromopyridine-4-carboxamide
CID 114194094
2,5-dibromo-N-pyrimidin-2-ylbenzamide
CID 1234506
2-amino-5-bromo-N-(4-hydroxycyclohexyl)pyridine-4-carboxamide
CID 114194050

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-bromo-N-(4-chloropyrimidin-2-yl)pyridine-4-carboxamide?
The IUPAC name of 2-amino-5-bromo-N-(4-chloropyrimidin-2-yl)pyridine-4-carboxamide (CID 114194072) is 2-amino-5-bromo-N-(4-chloropyrimidin-2-yl)pyridine-4-carboxamide.
What is the SMILES notation for 2-amino-5-bromo-N-(4-chloropyrimidin-2-yl)pyridine-4-carboxamide?
The canonical SMILES for 2-amino-5-bromo-N-(4-chloropyrimidin-2-yl)pyridine-4-carboxamide is Nc1cc(C(=O)Nc2nccc(Cl)n2)c(Br)cn1.
What is the InChIKey of 2-amino-5-bromo-N-(4-chloropyrimidin-2-yl)pyridine-4-carboxamide?
The InChIKey is JYWWFISQPCOYNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7BrClN5O/c11-6-4-15-8(13)3-5(6)9(18)17-10-14-2-1-7(12)16-10/h1-4H,(H2,13,15)(H,14,16,17,18).
What are the key properties of 2-amino-5-bromo-N-(4-chloropyrimidin-2-yl)pyridine-4-carboxamide?
2-amino-5-bromo-N-(4-chloropyrimidin-2-yl)pyridine-4-carboxamide has a molecular weight of 328.56 g/mol, XLogP of 2.12, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-bromo-N-(4-chloropyrimidin-2-yl)pyridine-4-carboxamide is sourced from PubChem (CID 114194072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).