4-amino-1-ethyl-N-[2-(3-fluorophenyl)ethyl]pyrazole-3-carboxamide

C14H17FN4O — CID 65357986

IUPAC4-amino-1-ethyl-N-[2-(3-fluorophenyl)ethyl]pyrazole-3-carboxamide
SMILESCCn1cc(N)c(C(=O)NCCc2cccc(F)c2)n1
InChIInChI=1S/C14H17FN4O/c1-2-19-9-12(16)13(18-19)14(20)17-7-6-10-4-3-5-11(15)8-10/h3-5,8-9H,2,6-7,16H2,1H3,(H,17,20)
InChIKeyKHICJMGOMLVDQC-UHFFFAOYSA-N
MW276.31 g/mol
LogP1.60
Rot. Bonds5

About 4-amino-1-ethyl-N-[2-(3-fluorophenyl)ethyl]pyrazole-3-carboxamide

4-amino-1-ethyl-N-[2-(3-fluorophenyl)ethyl]pyrazole-3-carboxamide (PubChem CID 65357986) has the molecular formula C14H17FN4O and a molecular weight of 276.31 g/mol. Its IUPAC name is 4-amino-1-ethyl-N-[2-(3-fluorophenyl)ethyl]pyrazole-3-carboxamide.

Molecular Properties

Compound Name4-amino-1-ethyl-N-[2-(3-fluorophenyl)ethyl]pyrazole-3-carboxamide
PubChem CID65357986
Molecular FormulaC14H17FN4O
Molecular Weight276.31 g/mol
Exact Mass276.14
IUPAC Name4-amino-1-ethyl-N-[2-(3-fluorophenyl)ethyl]pyrazole-3-carboxamide
SMILESCCn1cc(N)c(C(=O)NCCc2cccc(F)c2)n1
InChIInChI=1S/C14H17FN4O/c1-2-19-9-12(16)13(18-19)14(20)17-7-6-10-4-3-5-11(15)8-10/h3-5,8-9H,2,6-7,16H2,1H3,(H,17,20)
InChIKeyKHICJMGOMLVDQC-UHFFFAOYSA-N
XLogP1.60
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.31
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-amino-1-ethyl-N-[2-(3-fluorophenyl)ethyl]pyrazole-3-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

4-amino-1-ethyl-N-(2-thiophen-3-ylethyl)pyrazole-3-carboxamide
CID 65358162
4-amino-1-ethyl-N-[1-(3-fluorophenyl)ethyl]pyrazole-3-carboxamide
CID 65357729
4-amino-N-benzyl-1-ethylpyrazole-3-carboxamide
CID 19620451
4-amino-1-ethyl-N-(2-hydroxyethyl)pyrazole-3-carboxamide
CID 65359089
4-amino-N-(2,3-difluorophenyl)-1-ethylpyrazole-3-carboxamide
CID 65357898
4-amino-1-ethyl-N-[(4-ethylphenyl)methyl]pyrazole-3-carboxamide
CID 106899160
4-amino-1-ethyl-N-[2-(2-methoxyphenyl)ethyl]pyrazole-3-carboxamide
CID 106259547
3-amino-1-ethyl-N-[2-(3-fluorophenyl)ethyl]pyrazole-4-sulfonamide
CID 60809119
4-amino-N-[2-(diethylamino)ethyl]-1-ethylpyrazole-3-carboxamide
CID 65358786
4-amino-N-[2-(3-fluorophenyl)ethyl]benzamide
CID 43565816
4-amino-N-(2-bromo-5-fluorophenyl)-1-ethylpyrazole-3-carboxamide
CID 107624222
4-amino-1-methyl-N-(2-phenylethyl)pyrazole-3-carboxamide
CID 19620372

Frequently Asked Questions

What is the IUPAC name of 4-amino-1-ethyl-N-[2-(3-fluorophenyl)ethyl]pyrazole-3-carboxamide?
The IUPAC name of 4-amino-1-ethyl-N-[2-(3-fluorophenyl)ethyl]pyrazole-3-carboxamide (CID 65357986) is 4-amino-1-ethyl-N-[2-(3-fluorophenyl)ethyl]pyrazole-3-carboxamide.
What is the SMILES notation for 4-amino-1-ethyl-N-[2-(3-fluorophenyl)ethyl]pyrazole-3-carboxamide?
The canonical SMILES for 4-amino-1-ethyl-N-[2-(3-fluorophenyl)ethyl]pyrazole-3-carboxamide is CCn1cc(N)c(C(=O)NCCc2cccc(F)c2)n1.
What is the InChIKey of 4-amino-1-ethyl-N-[2-(3-fluorophenyl)ethyl]pyrazole-3-carboxamide?
The InChIKey is KHICJMGOMLVDQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17FN4O/c1-2-19-9-12(16)13(18-19)14(20)17-7-6-10-4-3-5-11(15)8-10/h3-5,8-9H,2,6-7,16H2,1H3,(H,17,20).
What are the key properties of 4-amino-1-ethyl-N-[2-(3-fluorophenyl)ethyl]pyrazole-3-carboxamide?
4-amino-1-ethyl-N-[2-(3-fluorophenyl)ethyl]pyrazole-3-carboxamide has a molecular weight of 276.31 g/mol, XLogP of 1.60, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1-ethyl-N-[2-(3-fluorophenyl)ethyl]pyrazole-3-carboxamide is sourced from PubChem (CID 65357986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).