2-amino-5-chloro-N-pyrimidin-5-ylpyridine-4-carboxamide

C10H8ClN5O — CID 107589913

IUPAC2-amino-5-chloro-N-pyrimidin-5-ylpyridine-4-carboxamide
SMILESNc1cc(C(=O)Nc2cncnc2)c(Cl)cn1
InChIInChI=1S/C10H8ClN5O/c11-8-4-15-9(12)1-7(8)10(17)16-6-2-13-5-14-3-6/h1-5H,(H2,12,15)(H,16,17)
InChIKeyFNIIITJFJDVVCG-UHFFFAOYSA-N
MW249.66 g/mol
LogP1.36
Rot. Bonds2

About 2-amino-5-chloro-N-pyrimidin-5-ylpyridine-4-carboxamide

2-amino-5-chloro-N-pyrimidin-5-ylpyridine-4-carboxamide (PubChem CID 107589913) has the molecular formula C10H8ClN5O and a molecular weight of 249.66 g/mol. Its IUPAC name is 2-amino-5-chloro-N-pyrimidin-5-ylpyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-5-chloro-N-pyrimidin-5-ylpyridine-4-carboxamide
PubChem CID107589913
Molecular FormulaC10H8ClN5O
Molecular Weight249.66 g/mol
Exact Mass249.04
IUPAC Name2-amino-5-chloro-N-pyrimidin-5-ylpyridine-4-carboxamide
SMILESNc1cc(C(=O)Nc2cncnc2)c(Cl)cn1
InChIInChI=1S/C10H8ClN5O/c11-8-4-15-9(12)1-7(8)10(17)16-6-2-13-5-14-3-6/h1-5H,(H2,12,15)(H,16,17)
InChIKeyFNIIITJFJDVVCG-UHFFFAOYSA-N
XLogP1.36
TPSA93.79 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.66
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-amino-5-chloro-N-thiophen-3-ylpyridine-4-carboxamide
CID 114923968
2-amino-5-chloro-N-methylpyridine-4-carboxamide
CID 114921748
2-amino-5-chloro-N-(4-propylphenyl)pyridine-4-carboxamide
CID 114922194
2-amino-5-chloro-N-[3-(trifluoromethyl)phenyl]pyridine-4-carboxamide
CID 114921483
2-amino-5-chloro-N-(2-chloro-4-iodophenyl)pyridine-4-carboxamide
CID 107606018
2-chloro-N-pyrimidin-5-ylfuran-3-carboxamide
CID 106812415
2-amino-5-chloro-N-(2-methyl-3-pyridinyl)pyridine-4-carboxamide
CID 114923980
2-amino-5-chloro-N-naphthalen-1-ylpyridine-4-carboxamide
CID 114921449
2-amino-5-chloro-N-isoquinolin-5-ylpyridine-4-carboxamide
CID 114922399
2-amino-5-chloro-N-(2-chloro-5-cyanophenyl)pyridine-4-carboxamide
CID 114924132
2-amino-N-(5-bromo-6-methyl-2-pyridinyl)-5-chloropyridine-4-carboxamide
CID 114923983
2-amino-5-chloro-N-(2-methylpropyl)pyridine-4-carboxamide
CID 114921737

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-chloro-N-pyrimidin-5-ylpyridine-4-carboxamide?
The IUPAC name of 2-amino-5-chloro-N-pyrimidin-5-ylpyridine-4-carboxamide (CID 107589913) is 2-amino-5-chloro-N-pyrimidin-5-ylpyridine-4-carboxamide.
What is the SMILES notation for 2-amino-5-chloro-N-pyrimidin-5-ylpyridine-4-carboxamide?
The canonical SMILES for 2-amino-5-chloro-N-pyrimidin-5-ylpyridine-4-carboxamide is Nc1cc(C(=O)Nc2cncnc2)c(Cl)cn1.
What is the InChIKey of 2-amino-5-chloro-N-pyrimidin-5-ylpyridine-4-carboxamide?
The InChIKey is FNIIITJFJDVVCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8ClN5O/c11-8-4-15-9(12)1-7(8)10(17)16-6-2-13-5-14-3-6/h1-5H,(H2,12,15)(H,16,17).
What are the key properties of 2-amino-5-chloro-N-pyrimidin-5-ylpyridine-4-carboxamide?
2-amino-5-chloro-N-pyrimidin-5-ylpyridine-4-carboxamide has a molecular weight of 249.66 g/mol, XLogP of 1.36, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-chloro-N-pyrimidin-5-ylpyridine-4-carboxamide is sourced from PubChem (CID 107589913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).