(2R)-2-pyrazol-1-yl-N-[(1S)-1-thiophen-2-ylethyl]propanamide

C12H15N3OS — CID 35699099

IUPAC(2R)-2-pyrazol-1-yl-N-[(1S)-1-thiophen-2-ylethyl]propanamide
SMILESC[C@H](NC(=O)[C@@H](C)n1cccn1)c1cccs1
InChIInChI=1S/C12H15N3OS/c1-9(11-5-3-8-17-11)14-12(16)10(2)15-7-4-6-13-15/h3-10H,1-2H3,(H,14,16)/t9-,10+/m0/s1
InChIKeyBVERBSAYYGAHSN-VHSXEESVSA-N
MW249.34 g/mol
LogP2.38
Rot. Bonds4

About (2R)-2-pyrazol-1-yl-N-[(1S)-1-thiophen-2-ylethyl]propanamide

(2R)-2-pyrazol-1-yl-N-[(1S)-1-thiophen-2-ylethyl]propanamide (PubChem CID 35699099) has the molecular formula C12H15N3OS and a molecular weight of 249.34 g/mol. Its IUPAC name is (2R)-2-pyrazol-1-yl-N-[(1S)-1-thiophen-2-ylethyl]propanamide.

Molecular Properties

Compound Name(2R)-2-pyrazol-1-yl-N-[(1S)-1-thiophen-2-ylethyl]propanamide
PubChem CID35699099
Molecular FormulaC12H15N3OS
Molecular Weight249.34 g/mol
Exact Mass249.09
IUPAC Name(2R)-2-pyrazol-1-yl-N-[(1S)-1-thiophen-2-ylethyl]propanamide
SMILESC[C@H](NC(=O)[C@@H](C)n1cccn1)c1cccs1
InChIInChI=1S/C12H15N3OS/c1-9(11-5-3-8-17-11)14-12(16)10(2)15-7-4-6-13-15/h3-10H,1-2H3,(H,14,16)/t9-,10+/m0/s1
InChIKeyBVERBSAYYGAHSN-VHSXEESVSA-N
XLogP2.38
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.34
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (2R)-2-pyrazol-1-yl-N-[(1S)-1-thiophen-2-ylethyl]propanamide 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-(4-bromophenyl)ethyl]-2-pyrazol-1-ylpropanamide
CID 47156459
methyl N-(2-pyrazol-1-yl-2-thiophen-2-ylethyl)carbamate
CID 122265033
(2R)-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-pyrazol-1-ylpropanamide
CID 94036104
(2R)-N-[(S)-phenyl(pyridin-4-yl)methyl]-2-pyrazol-1-ylpropanamide
CID 95934280
N'-(2-ethyl-1-thiophen-2-ylbutyl)-N-[3-(2-pyrazol-1-ylpropanoylamino)phenyl]oxamide
CID 167868090
(2R)-2-pyrazol-1-yl-N-(1,3-thiazol-2-yl)propanamide
CID 35503683
N-[1-(1H-benzimidazol-2-yl)ethyl]-2-pyrazol-1-ylpropanamide
CID 60731653
N-[(3-methylthiophen-2-yl)methyl]-2-pyrazol-1-ylpropanamide
CID 47163720
N-phenyl-2-pyrazol-1-ylpropanamide
CID 42949018
N-(1-aminopropan-2-yl)-2-pyrazol-1-ylpropanamide
CID 63732994
3-methyl-2-(2-pyrazol-1-ylpropanoylamino)butanoic acid
CID 43211034
N-(4-hydroxybutan-2-yl)-2-pyrazol-1-ylpropanamide
CID 81047310

Frequently Asked Questions

What is the IUPAC name of (2R)-2-pyrazol-1-yl-N-[(1S)-1-thiophen-2-ylethyl]propanamide?
The IUPAC name of (2R)-2-pyrazol-1-yl-N-[(1S)-1-thiophen-2-ylethyl]propanamide (CID 35699099) is (2R)-2-pyrazol-1-yl-N-[(1S)-1-thiophen-2-ylethyl]propanamide.
What is the SMILES notation for (2R)-2-pyrazol-1-yl-N-[(1S)-1-thiophen-2-ylethyl]propanamide?
The canonical SMILES for (2R)-2-pyrazol-1-yl-N-[(1S)-1-thiophen-2-ylethyl]propanamide is C[C@H](NC(=O)[C@@H](C)n1cccn1)c1cccs1.
What is the InChIKey of (2R)-2-pyrazol-1-yl-N-[(1S)-1-thiophen-2-ylethyl]propanamide?
The InChIKey is BVERBSAYYGAHSN-VHSXEESVSA-N. The full InChI is InChI=1S/C12H15N3OS/c1-9(11-5-3-8-17-11)14-12(16)10(2)15-7-4-6-13-15/h3-10H,1-2H3,(H,14,16)/t9-,10+/m0/s1.
What are the key properties of (2R)-2-pyrazol-1-yl-N-[(1S)-1-thiophen-2-ylethyl]propanamide?
(2R)-2-pyrazol-1-yl-N-[(1S)-1-thiophen-2-ylethyl]propanamide has a molecular weight of 249.34 g/mol, XLogP of 2.38, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-pyrazol-1-yl-N-[(1S)-1-thiophen-2-ylethyl]propanamide is sourced from PubChem (CID 35699099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).