1-methyl-3-(2-thiophen-2-ylethyl)pyrazol-5-amine

C10H13N3S — CID 82077522

IUPAC1-methyl-3-(2-thiophen-2-ylethyl)pyrazol-5-amine
SMILESCn1nc(CCc2cccs2)cc1N
InChIInChI=1S/C10H13N3S/c1-13-10(11)7-8(12-13)4-5-9-3-2-6-14-9/h2-3,6-7H,4-5,11H2,1H3
InChIKeyOAENLAXIHCWZBA-UHFFFAOYSA-N
MW207.30 g/mol
LogP1.85
Rot. Bonds3

About 1-methyl-3-(2-thiophen-2-ylethyl)pyrazol-5-amine

1-methyl-3-(2-thiophen-2-ylethyl)pyrazol-5-amine (PubChem CID 82077522) has the molecular formula C10H13N3S and a molecular weight of 207.30 g/mol. Its IUPAC name is 1-methyl-3-(2-thiophen-2-ylethyl)pyrazol-5-amine.

Molecular Properties

Compound Name1-methyl-3-(2-thiophen-2-ylethyl)pyrazol-5-amine
PubChem CID82077522
Molecular FormulaC10H13N3S
Molecular Weight207.30 g/mol
Exact Mass207.08
IUPAC Name1-methyl-3-(2-thiophen-2-ylethyl)pyrazol-5-amine
SMILESCn1nc(CCc2cccs2)cc1N
InChIInChI=1S/C10H13N3S/c1-13-10(11)7-8(12-13)4-5-9-3-2-6-14-9/h2-3,6-7H,4-5,11H2,1H3
InChIKeyOAENLAXIHCWZBA-UHFFFAOYSA-N
XLogP1.85
TPSA43.84 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 ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(2-thiophen-2-ylethyl)-1,2-oxazol-5-amine
CID 82075946
3-(aminomethyl)-1-methylpyrazol-5-amine
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CID 63773628
1-(2,5-dimethylpyrazol-3-yl)-3-thiophen-2-ylpropan-1-one
CID 105101493
3-ethyl-1-methyl-5-(2-thiophen-2-ylethoxy)pyrazol-4-amine
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CID 82470461
4-methyl-2-(2-thiophen-2-ylethyl)-1,2,4-triazol-3-one
CID 86797131
1,3-dimethyl-5-[methyl(2-thiophen-2-ylethyl)amino]pyrazole-4-carbothioamide
CID 79493990
1-methyl-3-(2-naphthalen-2-yloxyethyl)pyrazol-5-amine
CID 82092271
1-(2-thiophen-2-ylethyl)tetrazol-5-amine
CID 79506694
3-(2-thiophen-2-ylethyl)aniline
CID 170738786
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CID 67577780

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-(2-thiophen-2-ylethyl)pyrazol-5-amine?
The IUPAC name of 1-methyl-3-(2-thiophen-2-ylethyl)pyrazol-5-amine (CID 82077522) is 1-methyl-3-(2-thiophen-2-ylethyl)pyrazol-5-amine.
What is the SMILES notation for 1-methyl-3-(2-thiophen-2-ylethyl)pyrazol-5-amine?
The canonical SMILES for 1-methyl-3-(2-thiophen-2-ylethyl)pyrazol-5-amine is Cn1nc(CCc2cccs2)cc1N.
What is the InChIKey of 1-methyl-3-(2-thiophen-2-ylethyl)pyrazol-5-amine?
The InChIKey is OAENLAXIHCWZBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3S/c1-13-10(11)7-8(12-13)4-5-9-3-2-6-14-9/h2-3,6-7H,4-5,11H2,1H3.
What are the key properties of 1-methyl-3-(2-thiophen-2-ylethyl)pyrazol-5-amine?
1-methyl-3-(2-thiophen-2-ylethyl)pyrazol-5-amine has a molecular weight of 207.30 g/mol, XLogP of 1.85, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-(2-thiophen-2-ylethyl)pyrazol-5-amine is sourced from PubChem (CID 82077522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).