7-cyclopropylthieno[3,2-d]pyrimidine

C9H8N2S — CID 174703681

IUPAC7-cyclopropylthieno[3,2-d]pyrimidine
SMILESc1ncc2scc(C3CC3)c2n1
InChIInChI=1S/C9H8N2S/c1-2-6(1)7-4-12-8-3-10-5-11-9(7)8/h3-6H,1-2H2
InChIKeyIBEDLXDVECNGKB-UHFFFAOYSA-N
MW176.24 g/mol
LogP2.57
Rot. Bonds1

About 7-cyclopropylthieno[3,2-d]pyrimidine

7-cyclopropylthieno[3,2-d]pyrimidine (PubChem CID 174703681) has the molecular formula C9H8N2S and a molecular weight of 176.24 g/mol. Its IUPAC name is 7-cyclopropylthieno[3,2-d]pyrimidine.

Molecular Properties

Compound Name7-cyclopropylthieno[3,2-d]pyrimidine
PubChem CID174703681
Molecular FormulaC9H8N2S
Molecular Weight176.24 g/mol
Exact Mass176.04
IUPAC Name7-cyclopropylthieno[3,2-d]pyrimidine
SMILESc1ncc2scc(C3CC3)c2n1
InChIInChI=1S/C9H8N2S/c1-2-6(1)7-4-12-8-3-10-5-11-9(7)8/h3-6H,1-2H2
InChIKeyIBEDLXDVECNGKB-UHFFFAOYSA-N
XLogP2.57
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.24
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-methylthieno[3,2-d]pyrimidin-7-amine
CID 142501117
2-cyclopropyl-[1,3]thiazolo[4,5-d]pyrimidine
CID 141192936
3-cyclopropylthieno[2,3-b]pyridine
CID 119087285
4-cyclopropyl-2-pyrimidin-5-yl-1,3-thiazole
CID 131084886
N-(5-chloro-2-cyclohexyloxyphenyl)thieno[3,2-d]pyrimidine-7-carboxamide
CID 66665366
4-[5-(4-fluorophenyl)pyrrolo[3,2-d]pyrimidin-7-yl]cyclohexan-1-ol
CID 118446782
trimethyl(4-thiatricyclo[5.2.2.02,6]undeca-2,5-dien-3-yl)stannane
CID 71654607
2-phenyl-1-thieno[3,2-d]pyrimidin-7-ylethanesulfonamide
CID 175768630
(4-cyclopropylpyrimidin-5-yl)methanol
CID 126972771
N-(2-methoxyphenyl)thieno[3,2-d]pyrimidine-7-carboxamide
CID 58056378
N-(4-amino-2,6-dichloro-3,5-dimethylphenyl)thieno[3,2-d]pyrimidine-7-carboxamide
CID 140601623
4-chloro-5-cyclopropyl-2-methylthieno[2,3-d]pyrimidine
CID 82057591

Frequently Asked Questions

What is the IUPAC name of 7-cyclopropylthieno[3,2-d]pyrimidine?
The IUPAC name of 7-cyclopropylthieno[3,2-d]pyrimidine (CID 174703681) is 7-cyclopropylthieno[3,2-d]pyrimidine.
What is the SMILES notation for 7-cyclopropylthieno[3,2-d]pyrimidine?
The canonical SMILES for 7-cyclopropylthieno[3,2-d]pyrimidine is c1ncc2scc(C3CC3)c2n1.
What is the InChIKey of 7-cyclopropylthieno[3,2-d]pyrimidine?
The InChIKey is IBEDLXDVECNGKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2S/c1-2-6(1)7-4-12-8-3-10-5-11-9(7)8/h3-6H,1-2H2.
What are the key properties of 7-cyclopropylthieno[3,2-d]pyrimidine?
7-cyclopropylthieno[3,2-d]pyrimidine has a molecular weight of 176.24 g/mol, XLogP of 2.57, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-cyclopropylthieno[3,2-d]pyrimidine is sourced from PubChem (CID 174703681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).