N'-[[1-(2-fluorophenyl)pyrazol-3-yl]methyl]cyclopropanecarbohydrazide

C14H15FN4O — CID 171823053

IUPACN'-[[1-(2-fluorophenyl)pyrazol-3-yl]methyl]cyclopropanecarbohydrazide
SMILESO=C(NNCc1ccn(-c2ccccc2F)n1)C1CC1
InChIInChI=1S/C14H15FN4O/c15-12-3-1-2-4-13(12)19-8-7-11(18-19)9-16-17-14(20)10-5-6-10/h1-4,7-8,10,16H,5-6,9H2,(H,17,20)
InChIKeyTTZINSDMGJHIMK-UHFFFAOYSA-N
MW274.30 g/mol
LogP1.54
Rot. Bonds5

About N'-[[1-(2-fluorophenyl)pyrazol-3-yl]methyl]cyclopropanecarbohydrazide

N'-[[1-(2-fluorophenyl)pyrazol-3-yl]methyl]cyclopropanecarbohydrazide (PubChem CID 171823053) has the molecular formula C14H15FN4O and a molecular weight of 274.30 g/mol. Its IUPAC name is N'-[[1-(2-fluorophenyl)pyrazol-3-yl]methyl]cyclopropanecarbohydrazide.

Molecular Properties

Compound NameN'-[[1-(2-fluorophenyl)pyrazol-3-yl]methyl]cyclopropanecarbohydrazide
PubChem CID171823053
Molecular FormulaC14H15FN4O
Molecular Weight274.30 g/mol
Exact Mass274.12
IUPAC NameN'-[[1-(2-fluorophenyl)pyrazol-3-yl]methyl]cyclopropanecarbohydrazide
SMILESO=C(NNCc1ccn(-c2ccccc2F)n1)C1CC1
InChIInChI=1S/C14H15FN4O/c15-12-3-1-2-4-13(12)19-8-7-11(18-19)9-16-17-14(20)10-5-6-10/h1-4,7-8,10,16H,5-6,9H2,(H,17,20)
InChIKeyTTZINSDMGJHIMK-UHFFFAOYSA-N
XLogP1.54
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.30
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

3-[4-[2-[1-(2-fluorophenyl)pyrazol-3-yl]acetyl]cyclohexyl]-1,3-oxazinan-2-one
CID 158095926
2-[4-[2-[1-(2-fluorophenyl)pyrazol-3-yl]acetyl]cyclohexyl]-1-quinolin-2-ylethanone
CID 58034000
1-(2-chloro-4-pyridinyl)-2-[4-[2-[1-(2-fluorophenyl)pyrazol-3-yl]acetyl]cyclohexyl]ethanone
CID 58034040
[1-(2-fluorophenyl)pyrazol-3-yl]-[3-(methylamino)piperidin-1-yl]methanone;hydrochloride
CID 119487860
1-(2-fluorophenyl)-N-(2-hydroxyethyl)pyrazole-3-carboxamide
CID 78869937
N-[1-(2-fluorophenyl)pyrazol-4-yl]cyclohexanecarboxamide
CID 141275060
N-[[1-(2-fluoro-3-methylphenyl)pyrazol-3-yl]methyl]cyclopropanamine
CID 114254035
2-[cyclopropyl-[1-(2-fluorophenyl)pyrazole-3-carbonyl]amino]acetic acid
CID 119194581
[(3S)-3-aminopyrrolidin-1-yl]-[1-(2-fluorophenyl)pyrazol-3-yl]methanone
CID 124574217
1-(2-fluorophenyl)pyrazole-3-carbonitrile
CID 116818280
2-cyclopropyl-2-[[1-(2-fluorophenyl)pyrazole-3-carbonyl]amino]acetic acid
CID 119213154
2-(3-cyclopropylpyrazol-1-yl)-6-fluorobenzoic acid
CID 79511541

Frequently Asked Questions

What is the IUPAC name of N'-[[1-(2-fluorophenyl)pyrazol-3-yl]methyl]cyclopropanecarbohydrazide?
The IUPAC name of N'-[[1-(2-fluorophenyl)pyrazol-3-yl]methyl]cyclopropanecarbohydrazide (CID 171823053) is N'-[[1-(2-fluorophenyl)pyrazol-3-yl]methyl]cyclopropanecarbohydrazide.
What is the SMILES notation for N'-[[1-(2-fluorophenyl)pyrazol-3-yl]methyl]cyclopropanecarbohydrazide?
The canonical SMILES for N'-[[1-(2-fluorophenyl)pyrazol-3-yl]methyl]cyclopropanecarbohydrazide is O=C(NNCc1ccn(-c2ccccc2F)n1)C1CC1.
What is the InChIKey of N'-[[1-(2-fluorophenyl)pyrazol-3-yl]methyl]cyclopropanecarbohydrazide?
The InChIKey is TTZINSDMGJHIMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN4O/c15-12-3-1-2-4-13(12)19-8-7-11(18-19)9-16-17-14(20)10-5-6-10/h1-4,7-8,10,16H,5-6,9H2,(H,17,20).
What are the key properties of N'-[[1-(2-fluorophenyl)pyrazol-3-yl]methyl]cyclopropanecarbohydrazide?
N'-[[1-(2-fluorophenyl)pyrazol-3-yl]methyl]cyclopropanecarbohydrazide has a molecular weight of 274.30 g/mol, XLogP of 1.54, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[[1-(2-fluorophenyl)pyrazol-3-yl]methyl]cyclopropanecarbohydrazide is sourced from PubChem (CID 171823053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).