3-fluoro-N-[2-(4-methylpyrazol-1-yl)ethyl]azetidine-1-carboxamide

C10H15FN4O — CID 126776995

IUPAC3-fluoro-N-[2-(4-methylpyrazol-1-yl)ethyl]azetidine-1-carboxamide
SMILESCc1cnn(CCNC(=O)N2CC(F)C2)c1
InChIInChI=1S/C10H15FN4O/c1-8-4-13-15(5-8)3-2-12-10(16)14-6-9(11)7-14/h4-5,9H,2-3,6-7H2,1H3,(H,12,16)
InChIKeyQJEMXIJWJSFOPO-UHFFFAOYSA-N
MW226.25 g/mol
LogP0.55
Rot. Bonds3

About 3-fluoro-N-[2-(4-methylpyrazol-1-yl)ethyl]azetidine-1-carboxamide

3-fluoro-N-[2-(4-methylpyrazol-1-yl)ethyl]azetidine-1-carboxamide (PubChem CID 126776995) has the molecular formula C10H15FN4O and a molecular weight of 226.25 g/mol. Its IUPAC name is 3-fluoro-N-[2-(4-methylpyrazol-1-yl)ethyl]azetidine-1-carboxamide.

Molecular Properties

Compound Name3-fluoro-N-[2-(4-methylpyrazol-1-yl)ethyl]azetidine-1-carboxamide
PubChem CID126776995
Molecular FormulaC10H15FN4O
Molecular Weight226.25 g/mol
Exact Mass226.12
IUPAC Name3-fluoro-N-[2-(4-methylpyrazol-1-yl)ethyl]azetidine-1-carboxamide
SMILESCc1cnn(CCNC(=O)N2CC(F)C2)c1
InChIInChI=1S/C10H15FN4O/c1-8-4-13-15(5-8)3-2-12-10(16)14-6-9(11)7-14/h4-5,9H,2-3,6-7H2,1H3,(H,12,16)
InChIKeyQJEMXIJWJSFOPO-UHFFFAOYSA-N
XLogP0.55
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.25
LogP ≤ 50.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-fluoro-N-[2-(4-methylpyrazol-1-yl)ethyl]azetidine-1-carboxamide 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-(4-methylpyrazol-1-yl)ethyl]morpholine-4-carboxamide
CID 113238079
N-[3-(4-methylpyrazol-1-yl)propyl]-1,3,3a,4,7,7a-hexahydroisoindole-2-carboxamide
CID 71990284
1-amino-N-[2-(4-methylpyrazol-1-yl)ethyl]cyclopropane-1-carboxamide
CID 103950251
2-chloro-N-[2-(4-methylpyrazol-1-yl)ethyl]propanamide
CID 103881624
4-amino-N-[2-(4-methylpyrazol-1-yl)ethyl]cyclohexane-1-carboxamide
CID 114130686
3,3-dimethyl-N-[3-(4-methylpyrazol-1-yl)propyl]pyrrolidine-1-carboxamide
CID 71868427
3-methyl-N-[2-(4-methylpyrazol-1-yl)ethyl]oxetane-3-carboxamide
CID 122571650
(2S)-2-hydroxy-4-[2-(4-methylpyrazol-1-yl)ethylcarbamoylamino]butanoic acid
CID 114131625
(3S,4S)-1-[2-(4-bromopyrazol-1-yl)ethylcarbamoyl]-4-(trifluoromethyl)pyrrolidine-3-carboxylic acid
CID 122014093
N-[3-(4-methylpyrazol-1-yl)propyl]acetamide
CID 19328226
4-methyl-N-[2-(4-methylpyrazol-1-yl)ethyl]piperidine-4-carboxamide
CID 114130706
1-(aminomethyl)-N-[2-(4-methylpyrazol-1-yl)ethyl]cyclobutane-1-carboxamide
CID 114130261

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-[2-(4-methylpyrazol-1-yl)ethyl]azetidine-1-carboxamide?
The IUPAC name of 3-fluoro-N-[2-(4-methylpyrazol-1-yl)ethyl]azetidine-1-carboxamide (CID 126776995) is 3-fluoro-N-[2-(4-methylpyrazol-1-yl)ethyl]azetidine-1-carboxamide.
What is the SMILES notation for 3-fluoro-N-[2-(4-methylpyrazol-1-yl)ethyl]azetidine-1-carboxamide?
The canonical SMILES for 3-fluoro-N-[2-(4-methylpyrazol-1-yl)ethyl]azetidine-1-carboxamide is Cc1cnn(CCNC(=O)N2CC(F)C2)c1.
What is the InChIKey of 3-fluoro-N-[2-(4-methylpyrazol-1-yl)ethyl]azetidine-1-carboxamide?
The InChIKey is QJEMXIJWJSFOPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15FN4O/c1-8-4-13-15(5-8)3-2-12-10(16)14-6-9(11)7-14/h4-5,9H,2-3,6-7H2,1H3,(H,12,16).
What are the key properties of 3-fluoro-N-[2-(4-methylpyrazol-1-yl)ethyl]azetidine-1-carboxamide?
3-fluoro-N-[2-(4-methylpyrazol-1-yl)ethyl]azetidine-1-carboxamide has a molecular weight of 226.25 g/mol, XLogP of 0.55, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-[2-(4-methylpyrazol-1-yl)ethyl]azetidine-1-carboxamide is sourced from PubChem (CID 126776995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).