3-(4,5-dimethyl-1H-pyrazol-3-yl)-N-[2-(2-ethyl-1,3-thiazol-4-yl)ethyl]propanamide

C15H22N4OS — CID 118787626

IUPAC3-(4,5-dimethyl-1H-pyrazol-3-yl)-N-[2-(2-ethyl-1,3-thiazol-4-yl)ethyl]propanamide
SMILESCCc1nc(CCNC(=O)CCc2n[nH]c(C)c2C)cs1
InChIInChI=1S/C15H22N4OS/c1-4-15-17-12(9-21-15)7-8-16-14(20)6-5-13-10(2)11(3)18-19-13/h9H,4-8H2,1-3H3,(H,16,20)(H,18,19)
InChIKeyQNSOQSTXIBUBND-UHFFFAOYSA-N
MW306.44 g/mol
LogP2.34
Rot. Bonds7

About 3-(4,5-dimethyl-1H-pyrazol-3-yl)-N-[2-(2-ethyl-1,3-thiazol-4-yl)ethyl]propanamide

3-(4,5-dimethyl-1H-pyrazol-3-yl)-N-[2-(2-ethyl-1,3-thiazol-4-yl)ethyl]propanamide (PubChem CID 118787626) has the molecular formula C15H22N4OS and a molecular weight of 306.44 g/mol. Its IUPAC name is 3-(4,5-dimethyl-1H-pyrazol-3-yl)-N-[2-(2-ethyl-1,3-thiazol-4-yl)ethyl]propanamide.

Molecular Properties

Compound Name3-(4,5-dimethyl-1H-pyrazol-3-yl)-N-[2-(2-ethyl-1,3-thiazol-4-yl)ethyl]propanamide
PubChem CID118787626
Molecular FormulaC15H22N4OS
Molecular Weight306.44 g/mol
Exact Mass306.15
IUPAC Name3-(4,5-dimethyl-1H-pyrazol-3-yl)-N-[2-(2-ethyl-1,3-thiazol-4-yl)ethyl]propanamide
SMILESCCc1nc(CCNC(=O)CCc2n[nH]c(C)c2C)cs1
InChIInChI=1S/C15H22N4OS/c1-4-15-17-12(9-21-15)7-8-16-14(20)6-5-13-10(2)11(3)18-19-13/h9H,4-8H2,1-3H3,(H,16,20)(H,18,19)
InChIKeyQNSOQSTXIBUBND-UHFFFAOYSA-N
XLogP2.34
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.44
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-(4,5-dimethyl-1H-pyrazol-3-yl)-N-[2-(2-ethyl-1,3-thiazol-4-yl)ethyl]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-[2-(2-ethyl-1,3-thiazol-4-yl)ethyl]-3-(5-methyltetrazol-1-yl)propanamide
CID 122565023
N-[2-(2-ethyl-1,3-thiazol-4-yl)ethyl]-2-pyrrolidin-2-ylacetamide
CID 119869571
(2S)-2-amino-N-[2-(2-ethyl-1,3-thiazol-4-yl)ethyl]butanamide
CID 119869551
(2S)-2-amino-N-[2-(2-ethyl-1,3-thiazol-4-yl)ethyl]butanamide;dihydrochloride
CID 119869550
N-[2-(4-chlorophenyl)sulfanylethyl]-3-(4,5-dimethyl-1H-pyrazol-3-yl)propanamide
CID 74248623
N-[(2-ethyl-1,3-thiazol-4-yl)methyl]-4-(methylamino)butanamide
CID 119882244
5-bromo-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]pentanamide
CID 106033629
2-amino-N-[2-(2-ethyl-1,3-thiazol-4-yl)ethyl]-1,3-thiazole-4-carboxamide
CID 122567185
2-(2-ethyl-1,3-thiazol-4-yl)ethanol
CID 55264368
N-[(4-ethyl-1,3-thiazol-2-yl)methyl]-3-(1H-pyrazol-4-yl)propanamide
CID 131919090
3-(4-ethylphenyl)-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]propanamide
CID 110739218
1-[2-(2-ethyl-1,3-thiazol-4-yl)ethyl]-3-(3-hydroxy-2,2,4-trimethylpentyl)urea
CID 109389950

Frequently Asked Questions

What is the IUPAC name of 3-(4,5-dimethyl-1H-pyrazol-3-yl)-N-[2-(2-ethyl-1,3-thiazol-4-yl)ethyl]propanamide?
The IUPAC name of 3-(4,5-dimethyl-1H-pyrazol-3-yl)-N-[2-(2-ethyl-1,3-thiazol-4-yl)ethyl]propanamide (CID 118787626) is 3-(4,5-dimethyl-1H-pyrazol-3-yl)-N-[2-(2-ethyl-1,3-thiazol-4-yl)ethyl]propanamide.
What is the SMILES notation for 3-(4,5-dimethyl-1H-pyrazol-3-yl)-N-[2-(2-ethyl-1,3-thiazol-4-yl)ethyl]propanamide?
The canonical SMILES for 3-(4,5-dimethyl-1H-pyrazol-3-yl)-N-[2-(2-ethyl-1,3-thiazol-4-yl)ethyl]propanamide is CCc1nc(CCNC(=O)CCc2n[nH]c(C)c2C)cs1.
What is the InChIKey of 3-(4,5-dimethyl-1H-pyrazol-3-yl)-N-[2-(2-ethyl-1,3-thiazol-4-yl)ethyl]propanamide?
The InChIKey is QNSOQSTXIBUBND-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4OS/c1-4-15-17-12(9-21-15)7-8-16-14(20)6-5-13-10(2)11(3)18-19-13/h9H,4-8H2,1-3H3,(H,16,20)(H,18,19).
What are the key properties of 3-(4,5-dimethyl-1H-pyrazol-3-yl)-N-[2-(2-ethyl-1,3-thiazol-4-yl)ethyl]propanamide?
3-(4,5-dimethyl-1H-pyrazol-3-yl)-N-[2-(2-ethyl-1,3-thiazol-4-yl)ethyl]propanamide has a molecular weight of 306.44 g/mol, XLogP of 2.34, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4,5-dimethyl-1H-pyrazol-3-yl)-N-[2-(2-ethyl-1,3-thiazol-4-yl)ethyl]propanamide is sourced from PubChem (CID 118787626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).