[2-[2-(methylamino)thieno[2,3-d]pyrimidin-4-yl]oxyphenyl]methanol

C14H13N3O2S — CID 103332566

IUPAC[2-[2-(methylamino)thieno[2,3-d]pyrimidin-4-yl]oxyphenyl]methanol
SMILESCNc1nc(Oc2ccccc2CO)c2ccsc2n1
InChIInChI=1S/C14H13N3O2S/c1-15-14-16-12(10-6-7-20-13(10)17-14)19-11-5-3-2-4-9(11)8-18/h2-7,18H,8H2,1H3,(H,15,16,17)
InChIKeyGVSOONHEGDQOBF-UHFFFAOYSA-N
MW287.34 g/mol
LogP3.02
Rot. Bonds4

About [2-[2-(methylamino)thieno[2,3-d]pyrimidin-4-yl]oxyphenyl]methanol

[2-[2-(methylamino)thieno[2,3-d]pyrimidin-4-yl]oxyphenyl]methanol (PubChem CID 103332566) has the molecular formula C14H13N3O2S and a molecular weight of 287.34 g/mol. Its IUPAC name is [2-[2-(methylamino)thieno[2,3-d]pyrimidin-4-yl]oxyphenyl]methanol.

Molecular Properties

Compound Name[2-[2-(methylamino)thieno[2,3-d]pyrimidin-4-yl]oxyphenyl]methanol
PubChem CID103332566
Molecular FormulaC14H13N3O2S
Molecular Weight287.34 g/mol
Exact Mass287.07
IUPAC Name[2-[2-(methylamino)thieno[2,3-d]pyrimidin-4-yl]oxyphenyl]methanol
SMILESCNc1nc(Oc2ccccc2CO)c2ccsc2n1
InChIInChI=1S/C14H13N3O2S/c1-15-14-16-12(10-6-7-20-13(10)17-14)19-11-5-3-2-4-9(11)8-18/h2-7,18H,8H2,1H3,(H,15,16,17)
InChIKeyGVSOONHEGDQOBF-UHFFFAOYSA-N
XLogP3.02
TPSA67.27 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.34
LogP ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze [2-[2-(methylamino)thieno[2,3-d]pyrimidin-4-yl]oxyphenyl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-ethyl-4-(2-ethylphenoxy)thieno[2,3-d]pyrimidin-2-amine
CID 103332005
4-(2,3-difluorophenoxy)-N-methylthieno[2,3-d]pyrimidin-2-amine
CID 103332516
N-ethyl-4-(2-methylphenoxy)thieno[2,3-d]pyrimidin-2-amine
CID 103331842
4-(2-chloro-5-methylphenoxy)-N-methylthieno[2,3-d]pyrimidin-2-amine
CID 103332016
N-methyl-4-prop-2-enoxythieno[2,3-d]pyrimidin-2-amine
CID 103331220
4-(2-methylphenoxy)-N-propylthieno[2,3-d]pyrimidin-2-amine
CID 103331849
N-methyl-4-prop-2-ynoxythieno[2,3-d]pyrimidin-2-amine
CID 103331246
N-methyl-4-(2,2,3,3,3-pentafluoropropoxy)thieno[2,3-d]pyrimidin-2-amine
CID 103333001
[4-(2-propan-2-ylphenoxy)thieno[2,3-d]pyrimidin-2-yl]hydrazine
CID 103336205
4-(cyclohexylmethoxy)-N-methylthieno[2,3-d]pyrimidin-2-amine
CID 103332489
4-N-[(2-ethylphenyl)methyl]-2-N-methylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103328357
4-but-3-yn-2-yloxy-N-methylthieno[2,3-d]pyrimidin-2-amine
CID 106795448

Frequently Asked Questions

What is the IUPAC name of [2-[2-(methylamino)thieno[2,3-d]pyrimidin-4-yl]oxyphenyl]methanol?
The IUPAC name of [2-[2-(methylamino)thieno[2,3-d]pyrimidin-4-yl]oxyphenyl]methanol (CID 103332566) is [2-[2-(methylamino)thieno[2,3-d]pyrimidin-4-yl]oxyphenyl]methanol.
What is the SMILES notation for [2-[2-(methylamino)thieno[2,3-d]pyrimidin-4-yl]oxyphenyl]methanol?
The canonical SMILES for [2-[2-(methylamino)thieno[2,3-d]pyrimidin-4-yl]oxyphenyl]methanol is CNc1nc(Oc2ccccc2CO)c2ccsc2n1.
What is the InChIKey of [2-[2-(methylamino)thieno[2,3-d]pyrimidin-4-yl]oxyphenyl]methanol?
The InChIKey is GVSOONHEGDQOBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3O2S/c1-15-14-16-12(10-6-7-20-13(10)17-14)19-11-5-3-2-4-9(11)8-18/h2-7,18H,8H2,1H3,(H,15,16,17).
What are the key properties of [2-[2-(methylamino)thieno[2,3-d]pyrimidin-4-yl]oxyphenyl]methanol?
[2-[2-(methylamino)thieno[2,3-d]pyrimidin-4-yl]oxyphenyl]methanol has a molecular weight of 287.34 g/mol, XLogP of 3.02, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[2-(methylamino)thieno[2,3-d]pyrimidin-4-yl]oxyphenyl]methanol is sourced from PubChem (CID 103332566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).