N-[1-(oxolan-2-ylmethyl)pyrazol-4-yl]thieno[3,2-d]pyrimidine-4-carboxamide

C15H15N5O2S — CID 136553327

IUPACN-[1-(oxolan-2-ylmethyl)pyrazol-4-yl]thieno[3,2-d]pyrimidine-4-carboxamide
SMILESO=C(Nc1cnn(CC2CCCO2)c1)c1ncnc2ccsc12
InChIInChI=1S/C15H15N5O2S/c21-15(13-14-12(3-5-23-14)16-9-17-13)19-10-6-18-20(7-10)8-11-2-1-4-22-11/h3,5-7,9,11H,1-2,4,8H2,(H,19,21)
InChIKeyMONWVQSQVGAQNQ-UHFFFAOYSA-N
MW329.39 g/mol
LogP2.32
Rot. Bonds4

About N-[1-(oxolan-2-ylmethyl)pyrazol-4-yl]thieno[3,2-d]pyrimidine-4-carboxamide

N-[1-(oxolan-2-ylmethyl)pyrazol-4-yl]thieno[3,2-d]pyrimidine-4-carboxamide (PubChem CID 136553327) has the molecular formula C15H15N5O2S and a molecular weight of 329.39 g/mol. Its IUPAC name is N-[1-(oxolan-2-ylmethyl)pyrazol-4-yl]thieno[3,2-d]pyrimidine-4-carboxamide.

Molecular Properties

Compound NameN-[1-(oxolan-2-ylmethyl)pyrazol-4-yl]thieno[3,2-d]pyrimidine-4-carboxamide
PubChem CID136553327
Molecular FormulaC15H15N5O2S
Molecular Weight329.39 g/mol
Exact Mass329.09
IUPAC NameN-[1-(oxolan-2-ylmethyl)pyrazol-4-yl]thieno[3,2-d]pyrimidine-4-carboxamide
SMILESO=C(Nc1cnn(CC2CCCO2)c1)c1ncnc2ccsc12
InChIInChI=1S/C15H15N5O2S/c21-15(13-14-12(3-5-23-14)16-9-17-13)19-10-6-18-20(7-10)8-11-2-1-4-22-11/h3,5-7,9,11H,1-2,4,8H2,(H,19,21)
InChIKeyMONWVQSQVGAQNQ-UHFFFAOYSA-N
XLogP2.32
TPSA81.93 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.39
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-[1-(oxolan-2-ylmethyl)pyrazol-4-yl]thieno[3,2-d]pyrimidine-4-carboxamide 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-[1-(oxolan-2-ylmethyl)pyrazol-4-yl]thiophene-2-carboxamide
CID 60782178
3-methoxy-N-[1-(oxolan-2-ylmethyl)pyrazol-4-yl]thiophene-2-carboxamide
CID 136524086
3-(methoxymethyl)-N-[1-(oxolan-2-ylmethyl)pyrazol-4-yl]thiophene-2-carboxamide
CID 136521322
5-chloro-N-[1-(oxolan-2-ylmethyl)pyrazol-4-yl]thiophene-2-carboxamide
CID 47327915
N-[1-[[(2R)-oxolan-2-yl]methyl]pyrazol-4-yl]-2-thiophen-2-ylacetamide
CID 94811903
N-[1-(oxolan-2-ylmethyl)pyrazol-4-yl]naphthalene-2-carboxamide
CID 165126942
4-chloro-N-[1-(oxan-2-ylmethyl)pyrazol-4-yl]benzamide
CID 121145185
N-[1-[[(2R)-oxolan-2-yl]methyl]pyrazol-4-yl]-8-azaspiro[4.5]decane-8-carboxamide
CID 95899494
4-methyl-N-[1-(oxan-2-ylmethyl)pyrazol-4-yl]piperazine-1-carboxamide
CID 121145358
2-amino-3,3-dimethyl-N-[1-(oxolan-2-ylmethyl)pyrazol-4-yl]butanamide
CID 76887991
N-[1-[[(2R)-oxolan-2-yl]methyl]pyrazol-4-yl]prop-2-enamide
CID 129365474
N-[1-(oxolan-2-ylmethyl)pyrazol-4-yl]-5,6,7,8-tetrahydroquinoline-2-carboxamide
CID 71911590

Frequently Asked Questions

What is the IUPAC name of N-[1-(oxolan-2-ylmethyl)pyrazol-4-yl]thieno[3,2-d]pyrimidine-4-carboxamide?
The IUPAC name of N-[1-(oxolan-2-ylmethyl)pyrazol-4-yl]thieno[3,2-d]pyrimidine-4-carboxamide (CID 136553327) is N-[1-(oxolan-2-ylmethyl)pyrazol-4-yl]thieno[3,2-d]pyrimidine-4-carboxamide.
What is the SMILES notation for N-[1-(oxolan-2-ylmethyl)pyrazol-4-yl]thieno[3,2-d]pyrimidine-4-carboxamide?
The canonical SMILES for N-[1-(oxolan-2-ylmethyl)pyrazol-4-yl]thieno[3,2-d]pyrimidine-4-carboxamide is O=C(Nc1cnn(CC2CCCO2)c1)c1ncnc2ccsc12.
What is the InChIKey of N-[1-(oxolan-2-ylmethyl)pyrazol-4-yl]thieno[3,2-d]pyrimidine-4-carboxamide?
The InChIKey is MONWVQSQVGAQNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N5O2S/c21-15(13-14-12(3-5-23-14)16-9-17-13)19-10-6-18-20(7-10)8-11-2-1-4-22-11/h3,5-7,9,11H,1-2,4,8H2,(H,19,21).
What are the key properties of N-[1-(oxolan-2-ylmethyl)pyrazol-4-yl]thieno[3,2-d]pyrimidine-4-carboxamide?
N-[1-(oxolan-2-ylmethyl)pyrazol-4-yl]thieno[3,2-d]pyrimidine-4-carboxamide has a molecular weight of 329.39 g/mol, XLogP of 2.32, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(oxolan-2-ylmethyl)pyrazol-4-yl]thieno[3,2-d]pyrimidine-4-carboxamide is sourced from PubChem (CID 136553327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).