4-amino-N,1-diethyl-N-(3-fluorophenyl)pyrazole-5-carboxamide

C14H17FN4O — CID 65359004

IUPAC4-amino-N,1-diethyl-N-(3-fluorophenyl)pyrazole-5-carboxamide
SMILESCCN(C(=O)c1c(N)cnn1CC)c1cccc(F)c1
InChIInChI=1S/C14H17FN4O/c1-3-18(11-7-5-6-10(15)8-11)14(20)13-12(16)9-17-19(13)4-2/h5-9H,3-4,16H2,1-2H3
InChIKeyRAYDWBQXZLHDNZ-UHFFFAOYSA-N
MW276.31 g/mol
LogP2.29
Rot. Bonds4

About 4-amino-N,1-diethyl-N-(3-fluorophenyl)pyrazole-5-carboxamide

4-amino-N,1-diethyl-N-(3-fluorophenyl)pyrazole-5-carboxamide (PubChem CID 65359004) has the molecular formula C14H17FN4O and a molecular weight of 276.31 g/mol. Its IUPAC name is 4-amino-N,1-diethyl-N-(3-fluorophenyl)pyrazole-5-carboxamide.

Molecular Properties

Compound Name4-amino-N,1-diethyl-N-(3-fluorophenyl)pyrazole-5-carboxamide
PubChem CID65359004
Molecular FormulaC14H17FN4O
Molecular Weight276.31 g/mol
Exact Mass276.14
IUPAC Name4-amino-N,1-diethyl-N-(3-fluorophenyl)pyrazole-5-carboxamide
SMILESCCN(C(=O)c1c(N)cnn1CC)c1cccc(F)c1
InChIInChI=1S/C14H17FN4O/c1-3-18(11-7-5-6-10(15)8-11)14(20)13-12(16)9-17-19(13)4-2/h5-9H,3-4,16H2,1-2H3
InChIKeyRAYDWBQXZLHDNZ-UHFFFAOYSA-N
XLogP2.29
TPSA64.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.31
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-N-ethyl-N-(3-fluorophenyl)-1H-pyrazole-5-carboxamide
CID 63102705
6-amino-N-ethyl-N-(3-fluorophenyl)pyridine-2-carboxamide
CID 62238970
4-amino-N-ethyl-1-methyl-N-phenylpyrazole-5-carboxamide
CID 3112957
3-chloro-N-ethyl-N-(3-fluorophenyl)pyridine-4-carboxamide
CID 66482587
2-amino-N-ethyl-N-(3-fluorophenyl)-4-methyl-1,3-thiazole-5-carboxamide
CID 55115865
4-amino-N-cyclopropyl-N,1-diethylpyrazole-5-carboxamide
CID 65357045
N-ethyl-N-(3-fluorophenyl)-3,4-dihydroxybenzamide
CID 103956480
4-amino-N-[(2-bromo-5-fluorophenyl)methyl]-1-ethylpyrazole-5-carboxamide
CID 65358559
N-ethyl-4-fluoro-N-(3-fluorophenyl)-3-methylbenzamide
CID 63213412
N-ethyl-2-fluoro-N-(3-fluorophenyl)-4-methylbenzamide
CID 79769914
N-ethyl-N-(3-fluorophenyl)-1H-indazole-6-carboxamide
CID 62905806
4-amino-N-(2-chloro-4-fluorophenyl)-1-ethylpyrazole-5-carboxamide
CID 65357625

Frequently Asked Questions

What is the IUPAC name of 4-amino-N,1-diethyl-N-(3-fluorophenyl)pyrazole-5-carboxamide?
The IUPAC name of 4-amino-N,1-diethyl-N-(3-fluorophenyl)pyrazole-5-carboxamide (CID 65359004) is 4-amino-N,1-diethyl-N-(3-fluorophenyl)pyrazole-5-carboxamide.
What is the SMILES notation for 4-amino-N,1-diethyl-N-(3-fluorophenyl)pyrazole-5-carboxamide?
The canonical SMILES for 4-amino-N,1-diethyl-N-(3-fluorophenyl)pyrazole-5-carboxamide is CCN(C(=O)c1c(N)cnn1CC)c1cccc(F)c1.
What is the InChIKey of 4-amino-N,1-diethyl-N-(3-fluorophenyl)pyrazole-5-carboxamide?
The InChIKey is RAYDWBQXZLHDNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17FN4O/c1-3-18(11-7-5-6-10(15)8-11)14(20)13-12(16)9-17-19(13)4-2/h5-9H,3-4,16H2,1-2H3.
What are the key properties of 4-amino-N,1-diethyl-N-(3-fluorophenyl)pyrazole-5-carboxamide?
4-amino-N,1-diethyl-N-(3-fluorophenyl)pyrazole-5-carboxamide has a molecular weight of 276.31 g/mol, XLogP of 2.29, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N,1-diethyl-N-(3-fluorophenyl)pyrazole-5-carboxamide is sourced from PubChem (CID 65359004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).