2-propyl-N-(thiophen-3-ylmethyl)pyrazol-3-amine;hydrochloride

C11H16ClN3S — CID 115606235

IUPAC2-propyl-N-(thiophen-3-ylmethyl)pyrazol-3-amine;hydrochloride
SMILESCCCn1nccc1NCc1ccsc1.Cl
InChIInChI=1S/C11H15N3S.ClH/c1-2-6-14-11(3-5-13-14)12-8-10-4-7-15-9-10;/h3-5,7,9,12H,2,6,8H2,1H3;1H
InChIKeyQXZIBOYWGSJEGY-UHFFFAOYSA-N
MW257.79 g/mol
LogP3.39
Rot. Bonds5

About 2-propyl-N-(thiophen-3-ylmethyl)pyrazol-3-amine;hydrochloride

2-propyl-N-(thiophen-3-ylmethyl)pyrazol-3-amine;hydrochloride (PubChem CID 115606235) has the molecular formula C11H16ClN3S and a molecular weight of 257.79 g/mol. Its IUPAC name is 2-propyl-N-(thiophen-3-ylmethyl)pyrazol-3-amine;hydrochloride.

Molecular Properties

Compound Name2-propyl-N-(thiophen-3-ylmethyl)pyrazol-3-amine;hydrochloride
PubChem CID115606235
Molecular FormulaC11H16ClN3S
Molecular Weight257.79 g/mol
Exact Mass257.08
IUPAC Name2-propyl-N-(thiophen-3-ylmethyl)pyrazol-3-amine;hydrochloride
SMILESCCCn1nccc1NCc1ccsc1.Cl
InChIInChI=1S/C11H15N3S.ClH/c1-2-6-14-11(3-5-13-14)12-8-10-4-7-15-9-10;/h3-5,7,9,12H,2,6,8H2,1H3;1H
InChIKeyQXZIBOYWGSJEGY-UHFFFAOYSA-N
XLogP3.39
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.79
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-propyl-N-(thiophen-3-ylmethyl)pyrazol-3-amine;hydrochloride 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

2-(cyclopropylmethyl)-N-(thiophen-3-ylmethyl)pyrazol-3-amine
CID 115702990
2-butan-2-yl-N-(thiophen-3-ylmethyl)pyrazol-3-amine;hydrochloride
CID 115606209
2-propyl-N-(pyridin-3-ylmethyl)pyrazol-3-amine;hydrochloride
CID 115606229
2-propyl-N-(1,3-thiazol-4-ylmethyl)pyrazol-3-amine
CID 115606212
N-(2-propylpyrazol-3-yl)-3-thiophen-3-ylpropanamide
CID 38995471
1-propyl-N-(thiophen-3-ylmethyl)tetrazol-5-amine
CID 4726983
N-[(1-methylpyrazol-3-yl)methyl]-2-propylpyrazol-3-amine
CID 115606222
N-(2-ethylbutyl)-2-propylpyrazol-3-amine
CID 115924285
1-(2-ethylpyrazol-3-yl)-N-(thiophen-3-ylmethyl)ethanamine
CID 19626652
N-(thiophen-3-ylmethyl)butan-1-amine;hydrochloride
CID 17332318
2-(1-methylpyrazol-4-yl)-N-(thiophen-3-ylmethyl)propan-2-amine
CID 115654957
2-ethyl-N-(1,3-thiazol-2-ylmethyl)pyrazol-3-amine
CID 131131813

Frequently Asked Questions

What is the IUPAC name of 2-propyl-N-(thiophen-3-ylmethyl)pyrazol-3-amine;hydrochloride?
The IUPAC name of 2-propyl-N-(thiophen-3-ylmethyl)pyrazol-3-amine;hydrochloride (CID 115606235) is 2-propyl-N-(thiophen-3-ylmethyl)pyrazol-3-amine;hydrochloride.
What is the SMILES notation for 2-propyl-N-(thiophen-3-ylmethyl)pyrazol-3-amine;hydrochloride?
The canonical SMILES for 2-propyl-N-(thiophen-3-ylmethyl)pyrazol-3-amine;hydrochloride is CCCn1nccc1NCc1ccsc1.Cl.
What is the InChIKey of 2-propyl-N-(thiophen-3-ylmethyl)pyrazol-3-amine;hydrochloride?
The InChIKey is QXZIBOYWGSJEGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3S.ClH/c1-2-6-14-11(3-5-13-14)12-8-10-4-7-15-9-10;/h3-5,7,9,12H,2,6,8H2,1H3;1H.
What are the key properties of 2-propyl-N-(thiophen-3-ylmethyl)pyrazol-3-amine;hydrochloride?
2-propyl-N-(thiophen-3-ylmethyl)pyrazol-3-amine;hydrochloride has a molecular weight of 257.79 g/mol, XLogP of 3.39, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propyl-N-(thiophen-3-ylmethyl)pyrazol-3-amine;hydrochloride is sourced from PubChem (CID 115606235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).