2-chloro-N-(1,5-naphthyridin-2-yl)thieno[3,2-d]pyrimidine-7-carboxamide

C15H8ClN5OS — CID 86689619

IUPAC2-chloro-N-(1,5-naphthyridin-2-yl)thieno[3,2-d]pyrimidine-7-carboxamide
SMILESO=C(Nc1ccc2ncccc2n1)c1csc2cnc(Cl)nc12
InChIInChI=1S/C15H8ClN5OS/c16-15-18-6-11-13(21-15)8(7-23-11)14(22)20-12-4-3-9-10(19-12)2-1-5-17-9/h1-7H,(H,19,20,22)
InChIKeyALIYFDGLUTVWKF-UHFFFAOYSA-N
MW341.78 g/mol
LogP3.54
Rot. Bonds2

About 2-chloro-N-(1,5-naphthyridin-2-yl)thieno[3,2-d]pyrimidine-7-carboxamide

2-chloro-N-(1,5-naphthyridin-2-yl)thieno[3,2-d]pyrimidine-7-carboxamide (PubChem CID 86689619) has the molecular formula C15H8ClN5OS and a molecular weight of 341.78 g/mol. Its IUPAC name is 2-chloro-N-(1,5-naphthyridin-2-yl)thieno[3,2-d]pyrimidine-7-carboxamide.

Molecular Properties

Compound Name2-chloro-N-(1,5-naphthyridin-2-yl)thieno[3,2-d]pyrimidine-7-carboxamide
PubChem CID86689619
Molecular FormulaC15H8ClN5OS
Molecular Weight341.78 g/mol
Exact Mass341.01
IUPAC Name2-chloro-N-(1,5-naphthyridin-2-yl)thieno[3,2-d]pyrimidine-7-carboxamide
SMILESO=C(Nc1ccc2ncccc2n1)c1csc2cnc(Cl)nc12
InChIInChI=1S/C15H8ClN5OS/c16-15-18-6-11-13(21-15)8(7-23-11)14(22)20-12-4-3-9-10(19-12)2-1-5-17-9/h1-7H,(H,19,20,22)
InChIKeyALIYFDGLUTVWKF-UHFFFAOYSA-N
XLogP3.54
TPSA80.66 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.78
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(1H-benzimidazol-2-yl)-2-chlorothieno[3,2-d]pyrimidine-7-carboxamide
CID 86689618
2-(1,5-naphthyridin-2-yl)thieno[3,2-d]pyrimidine-7-carboxamide
CID 174741319
2-(3-aminopropylamino)-N-(7-methoxyquinolin-6-yl)thieno[3,2-d]pyrimidine-7-carboxamide
CID 58056089
N-(4-methylphenyl)-1,5-naphthyridine-2-carboxamide
CID 70972115
N-(2-chloropyrimidin-4-yl)-2-iodobenzamide
CID 116795168
1-(5-cyclopropyl-1H-pyrazol-4-yl)-3-(1,5-naphthyridin-2-yl)urea
CID 167913870
2-chloro-7-(2-methylsulfanylphenyl)thieno[3,2-d]pyrimidine
CID 145172732
3-chloro-N-quinolin-6-ylpyridine-4-carboxamide
CID 66484536
N-(2-chloropyrimidin-4-yl)-2-ethylbenzamide
CID 116798386
2-[[(1S,2R)-2-aminocyclohexyl]amino]-N-(5,6-dimethoxy-2-pyridinyl)thieno[3,2-d]pyrimidine-7-carboxamide
CID 66664974
2-chloro-N-(6-methyl-1,3-benzothiazol-2-yl)pyridine-3-carboxamide
CID 3809613
2-(1,3-benzothiazol-2-yl)-N-(4-methyl-1,3-thiazol-2-yl)pyridine-3-carboxamide
CID 18858969

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(1,5-naphthyridin-2-yl)thieno[3,2-d]pyrimidine-7-carboxamide?
The IUPAC name of 2-chloro-N-(1,5-naphthyridin-2-yl)thieno[3,2-d]pyrimidine-7-carboxamide (CID 86689619) is 2-chloro-N-(1,5-naphthyridin-2-yl)thieno[3,2-d]pyrimidine-7-carboxamide.
What is the SMILES notation for 2-chloro-N-(1,5-naphthyridin-2-yl)thieno[3,2-d]pyrimidine-7-carboxamide?
The canonical SMILES for 2-chloro-N-(1,5-naphthyridin-2-yl)thieno[3,2-d]pyrimidine-7-carboxamide is O=C(Nc1ccc2ncccc2n1)c1csc2cnc(Cl)nc12.
What is the InChIKey of 2-chloro-N-(1,5-naphthyridin-2-yl)thieno[3,2-d]pyrimidine-7-carboxamide?
The InChIKey is ALIYFDGLUTVWKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H8ClN5OS/c16-15-18-6-11-13(21-15)8(7-23-11)14(22)20-12-4-3-9-10(19-12)2-1-5-17-9/h1-7H,(H,19,20,22).
What are the key properties of 2-chloro-N-(1,5-naphthyridin-2-yl)thieno[3,2-d]pyrimidine-7-carboxamide?
2-chloro-N-(1,5-naphthyridin-2-yl)thieno[3,2-d]pyrimidine-7-carboxamide has a molecular weight of 341.78 g/mol, XLogP of 3.54, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(1,5-naphthyridin-2-yl)thieno[3,2-d]pyrimidine-7-carboxamide is sourced from PubChem (CID 86689619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).