1-(4-chlorophenyl)-N'-[2-(2-fluorophenoxy)propanoyl]cyclopropane-1-carbohydrazide

C19H18ClFN2O3 — CID 24546269

IUPAC1-(4-chlorophenyl)-N'-[2-(2-fluorophenoxy)propanoyl]cyclopropane-1-carbohydrazide
SMILESCC(Oc1ccccc1F)C(=O)NNC(=O)C1(c2ccc(Cl)cc2)CC1
InChIInChI=1S/C19H18ClFN2O3/c1-12(26-16-5-3-2-4-15(16)21)17(24)22-23-18(25)19(10-11-19)13-6-8-14(20)9-7-13/h2-9,12H,10-11H2,1H3,(H,22,24)(H,23,25)
InChIKeyLIWJSENAWNPIHM-UHFFFAOYSA-N
MW376.82 g/mol
LogP3.13
Rot. Bonds5

About 1-(4-chlorophenyl)-N'-[2-(2-fluorophenoxy)propanoyl]cyclopropane-1-carbohydrazide

1-(4-chlorophenyl)-N'-[2-(2-fluorophenoxy)propanoyl]cyclopropane-1-carbohydrazide (PubChem CID 24546269) has the molecular formula C19H18ClFN2O3 and a molecular weight of 376.82 g/mol. Its IUPAC name is 1-(4-chlorophenyl)-N'-[2-(2-fluorophenoxy)propanoyl]cyclopropane-1-carbohydrazide.

Molecular Properties

Compound Name1-(4-chlorophenyl)-N'-[2-(2-fluorophenoxy)propanoyl]cyclopropane-1-carbohydrazide
PubChem CID24546269
Molecular FormulaC19H18ClFN2O3
Molecular Weight376.82 g/mol
Exact Mass376.10
IUPAC Name1-(4-chlorophenyl)-N'-[2-(2-fluorophenoxy)propanoyl]cyclopropane-1-carbohydrazide
SMILESCC(Oc1ccccc1F)C(=O)NNC(=O)C1(c2ccc(Cl)cc2)CC1
InChIInChI=1S/C19H18ClFN2O3/c1-12(26-16-5-3-2-4-15(16)21)17(24)22-23-18(25)19(10-11-19)13-6-8-14(20)9-7-13/h2-9,12H,10-11H2,1H3,(H,22,24)(H,23,25)
InChIKeyLIWJSENAWNPIHM-UHFFFAOYSA-N
XLogP3.13
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.82
LogP ≤ 53.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(2S)-N'-[2-(4-chlorophenoxy)acetyl]-2-(2-fluorophenoxy)propanehydrazide
CID 7927413
5-chloro-2-fluoro-N'-[(2S)-2-(2-fluorophenoxy)propanoyl]benzohydrazide
CID 9087475
1-[[(2S)-2-(2-fluorophenoxy)propanoyl]amino]-3-methylthiourea
CID 8767721
2-(2-fluorophenoxy)-N'-(2-methoxyacetyl)propanehydrazide
CID 47102861
2-(2-fluorophenoxy)-N'-[2-(2-fluorophenoxy)acetyl]propanehydrazide
CID 51156370
N'-[2-(2-fluorophenoxy)propanoyl]cyclobutanecarbohydrazide
CID 18158775
(2S)-N'-[2-(2,6-dichlorophenyl)acetyl]-2-(2-fluorophenoxy)propanehydrazide
CID 7760988
(2S)-N'-[2-(5-chloro-2-methoxyphenyl)acetyl]-2-(2-fluorophenoxy)propanehydrazide
CID 9087471
2,3-dichloro-N-[1-[2-[2-(2-fluorophenoxy)propanoyl]hydrazinyl]-1-oxopropan-2-yl]benzamide
CID 55741094
tert-butyl N-[[1-[[2-(2-fluorophenoxy)propanoylamino]carbamoyl]cyclopentyl]methyl]carbamate
CID 71855047
[(2S)-1-[2-[(2S)-2-(2-fluorophenoxy)propanoyl]hydrazinyl]-3-methyl-1-oxobutan-2-yl]urea
CID 9372574
2-(2-fluorophenoxy)-N'-[3-(4-fluorophenyl)propanoyl]propanehydrazide
CID 51195433

Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)-N'-[2-(2-fluorophenoxy)propanoyl]cyclopropane-1-carbohydrazide?
The IUPAC name of 1-(4-chlorophenyl)-N'-[2-(2-fluorophenoxy)propanoyl]cyclopropane-1-carbohydrazide (CID 24546269) is 1-(4-chlorophenyl)-N'-[2-(2-fluorophenoxy)propanoyl]cyclopropane-1-carbohydrazide.
What is the SMILES notation for 1-(4-chlorophenyl)-N'-[2-(2-fluorophenoxy)propanoyl]cyclopropane-1-carbohydrazide?
The canonical SMILES for 1-(4-chlorophenyl)-N'-[2-(2-fluorophenoxy)propanoyl]cyclopropane-1-carbohydrazide is CC(Oc1ccccc1F)C(=O)NNC(=O)C1(c2ccc(Cl)cc2)CC1.
What is the InChIKey of 1-(4-chlorophenyl)-N'-[2-(2-fluorophenoxy)propanoyl]cyclopropane-1-carbohydrazide?
The InChIKey is LIWJSENAWNPIHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18ClFN2O3/c1-12(26-16-5-3-2-4-15(16)21)17(24)22-23-18(25)19(10-11-19)13-6-8-14(20)9-7-13/h2-9,12H,10-11H2,1H3,(H,22,24)(H,23,25).
What are the key properties of 1-(4-chlorophenyl)-N'-[2-(2-fluorophenoxy)propanoyl]cyclopropane-1-carbohydrazide?
1-(4-chlorophenyl)-N'-[2-(2-fluorophenoxy)propanoyl]cyclopropane-1-carbohydrazide has a molecular weight of 376.82 g/mol, XLogP of 3.13, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)-N'-[2-(2-fluorophenoxy)propanoyl]cyclopropane-1-carbohydrazide is sourced from PubChem (CID 24546269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).