N-[(2,5-dimethylpyrazol-3-yl)methyl]thiophen-3-amine

C10H13N3S — CID 66351286

IUPACN-[(2,5-dimethylpyrazol-3-yl)methyl]thiophen-3-amine
SMILESCc1cc(CNc2ccsc2)n(C)n1
InChIInChI=1S/C10H13N3S/c1-8-5-10(13(2)12-8)6-11-9-3-4-14-7-9/h3-5,7,11H,6H2,1-2H3
InChIKeyPDJXKIMPXLNAES-UHFFFAOYSA-N
MW207.30 g/mol
LogP2.40
Rot. Bonds3

About N-[(2,5-dimethylpyrazol-3-yl)methyl]thiophen-3-amine

N-[(2,5-dimethylpyrazol-3-yl)methyl]thiophen-3-amine (PubChem CID 66351286) has the molecular formula C10H13N3S and a molecular weight of 207.30 g/mol. Its IUPAC name is N-[(2,5-dimethylpyrazol-3-yl)methyl]thiophen-3-amine.

Molecular Properties

Compound NameN-[(2,5-dimethylpyrazol-3-yl)methyl]thiophen-3-amine
PubChem CID66351286
Molecular FormulaC10H13N3S
Molecular Weight207.30 g/mol
Exact Mass207.08
IUPAC NameN-[(2,5-dimethylpyrazol-3-yl)methyl]thiophen-3-amine
SMILESCc1cc(CNc2ccsc2)n(C)n1
InChIInChI=1S/C10H13N3S/c1-8-5-10(13(2)12-8)6-11-9-3-4-14-7-9/h3-5,7,11H,6H2,1-2H3
InChIKeyPDJXKIMPXLNAES-UHFFFAOYSA-N
XLogP2.40
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.30
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[(2,5-dimethylpyrazol-3-yl)methyl]thiophen-3-amine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[(2,5-dimethylpyrazol-3-yl)methyl]thiophen-3-amine?
The IUPAC name of N-[(2,5-dimethylpyrazol-3-yl)methyl]thiophen-3-amine (CID 66351286) is N-[(2,5-dimethylpyrazol-3-yl)methyl]thiophen-3-amine.
What is the SMILES notation for N-[(2,5-dimethylpyrazol-3-yl)methyl]thiophen-3-amine?
The canonical SMILES for N-[(2,5-dimethylpyrazol-3-yl)methyl]thiophen-3-amine is Cc1cc(CNc2ccsc2)n(C)n1.
What is the InChIKey of N-[(2,5-dimethylpyrazol-3-yl)methyl]thiophen-3-amine?
The InChIKey is PDJXKIMPXLNAES-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3S/c1-8-5-10(13(2)12-8)6-11-9-3-4-14-7-9/h3-5,7,11H,6H2,1-2H3.
What are the key properties of N-[(2,5-dimethylpyrazol-3-yl)methyl]thiophen-3-amine?
N-[(2,5-dimethylpyrazol-3-yl)methyl]thiophen-3-amine has a molecular weight of 207.30 g/mol, XLogP of 2.40, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,5-dimethylpyrazol-3-yl)methyl]thiophen-3-amine is sourced from PubChem (CID 66351286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).