4-chloro-2-cyclopropylthieno[3,2-d]pyrimidine

C9H7ClN2S — CID 15055729

IUPAC4-chloro-2-cyclopropylthieno[3,2-d]pyrimidine
SMILESClc1nc(C2CC2)nc2ccsc12
InChIInChI=1S/C9H7ClN2S/c10-8-7-6(3-4-13-7)11-9(12-8)5-1-2-5/h3-5H,1-2H2
InChIKeyUDUAEQOLSZSONV-UHFFFAOYSA-N
MW210.69 g/mol
LogP3.22
Rot. Bonds1

About 4-chloro-2-cyclopropylthieno[3,2-d]pyrimidine

4-chloro-2-cyclopropylthieno[3,2-d]pyrimidine (PubChem CID 15055729) has the molecular formula C9H7ClN2S and a molecular weight of 210.69 g/mol. Its IUPAC name is 4-chloro-2-cyclopropylthieno[3,2-d]pyrimidine.

Molecular Properties

Compound Name4-chloro-2-cyclopropylthieno[3,2-d]pyrimidine
PubChem CID15055729
Molecular FormulaC9H7ClN2S
Molecular Weight210.69 g/mol
Exact Mass210.00
IUPAC Name4-chloro-2-cyclopropylthieno[3,2-d]pyrimidine
SMILESClc1nc(C2CC2)nc2ccsc12
InChIInChI=1S/C9H7ClN2S/c10-8-7-6(3-4-13-7)11-9(12-8)5-1-2-5/h3-5H,1-2H2
InChIKeyUDUAEQOLSZSONV-UHFFFAOYSA-N
XLogP3.22
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.69
LogP ≤ 53.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4,6-dichloro-2,5-dicyclopropylpyrimidine
CID 118990185
4-chloro-2-cyclopropylquinazolin-6-ol
CID 106584464
CID 153075735
CID 153075735
4-chloro-2-thiophen-3-ylthieno[3,2-d]pyrimidine
CID 130535740
7-bromo-4-chloro-2-(oxan-4-yl)thieno[3,2-d]pyrimidine
CID 122428575
4-chloro-2-(furan-2-yl)thieno[3,2-d]pyrimidine
CID 119089879
N-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]-N,2-dimethylthieno[3,2-d]pyrimidin-4-amine
CID 72861166
4,6-dichloro-2-cyclopropylpyrimidine-5-carbonitrile
CID 122200579
8-ethyl-6,10-dithia-2-azatricyclo[7.3.0.03,7]dodeca-1,3(7),4,8,11-pentaene
CID 10846537
(4,6-dichloro-2-cyclopropylpyrimidin-5-yl)methanol
CID 46941488
4-[(2-chlorothieno[3,2-d]pyrimidin-4-yl)amino]cyclohexan-1-ol
CID 112750276
4-chloro-2,6-dicyclopropylpyrimidin-5-amine
CID 88811496

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-cyclopropylthieno[3,2-d]pyrimidine?
The IUPAC name of 4-chloro-2-cyclopropylthieno[3,2-d]pyrimidine (CID 15055729) is 4-chloro-2-cyclopropylthieno[3,2-d]pyrimidine.
What is the SMILES notation for 4-chloro-2-cyclopropylthieno[3,2-d]pyrimidine?
The canonical SMILES for 4-chloro-2-cyclopropylthieno[3,2-d]pyrimidine is Clc1nc(C2CC2)nc2ccsc12.
What is the InChIKey of 4-chloro-2-cyclopropylthieno[3,2-d]pyrimidine?
The InChIKey is UDUAEQOLSZSONV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7ClN2S/c10-8-7-6(3-4-13-7)11-9(12-8)5-1-2-5/h3-5H,1-2H2.
What are the key properties of 4-chloro-2-cyclopropylthieno[3,2-d]pyrimidine?
4-chloro-2-cyclopropylthieno[3,2-d]pyrimidine has a molecular weight of 210.69 g/mol, XLogP of 3.22, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-cyclopropylthieno[3,2-d]pyrimidine is sourced from PubChem (CID 15055729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).