thieno[3,2-d]pyrimidin-2-ylmethanamine

C7H7N3S — CID 82414555

IUPACthieno[3,2-d]pyrimidin-2-ylmethanamine
SMILESNCc1ncc2sccc2n1
InChIInChI=1S/C7H7N3S/c8-3-7-9-4-6-5(10-7)1-2-11-6/h1-2,4H,3,8H2
InChIKeyKZNSCSBJUMVLRR-UHFFFAOYSA-N
MW165.22 g/mol
LogP1.15
Rot. Bonds1

About thieno[3,2-d]pyrimidin-2-ylmethanamine

thieno[3,2-d]pyrimidin-2-ylmethanamine (PubChem CID 82414555) has the molecular formula C7H7N3S and a molecular weight of 165.22 g/mol. Its IUPAC name is thieno[3,2-d]pyrimidin-2-ylmethanamine.

Molecular Properties

Compound Namethieno[3,2-d]pyrimidin-2-ylmethanamine
PubChem CID82414555
Molecular FormulaC7H7N3S
Molecular Weight165.22 g/mol
Exact Mass165.04
IUPAC Namethieno[3,2-d]pyrimidin-2-ylmethanamine
SMILESNCc1ncc2sccc2n1
InChIInChI=1S/C7H7N3S/c8-3-7-9-4-6-5(10-7)1-2-11-6/h1-2,4H,3,8H2
InChIKeyKZNSCSBJUMVLRR-UHFFFAOYSA-N
XLogP1.15
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.22
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

trans-(1S,3S)-3-(thieno[3,2-d]pyrimidin-2-ylmethyl)cyclopentan-1-amine
CID 159313291
2-fluorothieno[3,2-d]pyrimidine
CID 155821803
2-(piperidin-4-ylmethyl)thieno[3,2-d]pyrimidine
CID 141198481
2-[[4-(pyridin-3-ylmethyl)piperazin-1-yl]methyl]thieno[3,2-d]pyrimidine
CID 172780100
N-[(E)-pent-2-en-2-yl]thieno[3,2-d]pyrimidin-2-amine
CID 155032361
N-(2-bromoprop-2-enyl)thieno[3,2-d]pyrimidin-2-amine
CID 130986276
N-[2-(5-fluoro-2-pyridinyl)propyl]thieno[3,2-d]pyrimidin-2-amine
CID 166395521
propanediamide;thieno[3,2-d]pyrimidine
CID 67279021
[(2R)-1-thieno[3,2-d]pyrimidin-2-ylpyrrolidin-2-yl]methanol
CID 90958967
N-[(3,4,5-trimethoxyphenyl)methyl]thieno[3,2-d]pyrimidin-2-amine
CID 163723742
4,10-dithia-2,8-diazatricyclo[7.3.0.03,7]dodeca-1(9),2,5,7,11-pentaene
CID 121433174
3,10-dithia-7-azatricyclo[7.3.0.02,6]dodeca-1,4,6,8,11-pentaene;zinc
CID 174764383

Frequently Asked Questions

What is the IUPAC name of thieno[3,2-d]pyrimidin-2-ylmethanamine?
The IUPAC name of thieno[3,2-d]pyrimidin-2-ylmethanamine (CID 82414555) is thieno[3,2-d]pyrimidin-2-ylmethanamine.
What is the SMILES notation for thieno[3,2-d]pyrimidin-2-ylmethanamine?
The canonical SMILES for thieno[3,2-d]pyrimidin-2-ylmethanamine is NCc1ncc2sccc2n1.
What is the InChIKey of thieno[3,2-d]pyrimidin-2-ylmethanamine?
The InChIKey is KZNSCSBJUMVLRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N3S/c8-3-7-9-4-6-5(10-7)1-2-11-6/h1-2,4H,3,8H2.
What are the key properties of thieno[3,2-d]pyrimidin-2-ylmethanamine?
thieno[3,2-d]pyrimidin-2-ylmethanamine has a molecular weight of 165.22 g/mol, XLogP of 1.15, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for thieno[3,2-d]pyrimidin-2-ylmethanamine is sourced from PubChem (CID 82414555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).