N'-[3-(2-chlorophenyl)propanoyl]furan-2-carbohydrazide

C14H13ClN2O3 — CID 29436828

IUPACN'-[3-(2-chlorophenyl)propanoyl]furan-2-carbohydrazide
SMILESO=C(CCc1ccccc1Cl)NNC(=O)c1ccco1
InChIInChI=1S/C14H13ClN2O3/c15-11-5-2-1-4-10(11)7-8-13(18)16-17-14(19)12-6-3-9-20-12/h1-6,9H,7-8H2,(H,16,18)(H,17,19)
InChIKeyVKSJRUXRYBTENV-UHFFFAOYSA-N
MW292.72 g/mol
LogP2.33
Rot. Bonds4

About N'-[3-(2-chlorophenyl)propanoyl]furan-2-carbohydrazide

N'-[3-(2-chlorophenyl)propanoyl]furan-2-carbohydrazide (PubChem CID 29436828) has the molecular formula C14H13ClN2O3 and a molecular weight of 292.72 g/mol. Its IUPAC name is N'-[3-(2-chlorophenyl)propanoyl]furan-2-carbohydrazide.

Molecular Properties

Compound NameN'-[3-(2-chlorophenyl)propanoyl]furan-2-carbohydrazide
PubChem CID29436828
Molecular FormulaC14H13ClN2O3
Molecular Weight292.72 g/mol
Exact Mass292.06
IUPAC NameN'-[3-(2-chlorophenyl)propanoyl]furan-2-carbohydrazide
SMILESO=C(CCc1ccccc1Cl)NNC(=O)c1ccco1
InChIInChI=1S/C14H13ClN2O3/c15-11-5-2-1-4-10(11)7-8-13(18)16-17-14(19)12-6-3-9-20-12/h1-6,9H,7-8H2,(H,16,18)(H,17,19)
InChIKeyVKSJRUXRYBTENV-UHFFFAOYSA-N
XLogP2.33
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.72
LogP ≤ 52.33
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

N'-(3-aminopropanoyl)-3-(2-chlorophenyl)propanehydrazide
CID 94279919
N-benzyl-4-[2-[3-(2-chlorophenyl)propanoyl]hydrazinyl]-4-oxobutanamide
CID 17179143
N'-[3-(2-chlorophenyl)propanoyl]-4-phenylbenzohydrazide
CID 17179113
2-(2-chlorophenyl)-1-(furan-2-yl)ethanone
CID 61055441
N'-[3-(2-chlorophenyl)propanoyl]-5-(phenoxymethyl)furan-2-carbohydrazide
CID 31464668
(2-chlorophenyl)methyl 3-(furan-2-carbonylamino)propanoate
CID 46796022
N-[(2-chlorophenyl)methylsulfonyl]furan-2-carboxamide
CID 71859596
N'-[3-(2-chlorophenyl)propanoyl]pyridine-3-carbohydrazide
CID 30944808
N-[4-[[3-(2-chlorophenyl)propanoylamino]carbamoyl]phenyl]acetamide
CID 17179121
N-[(2-chlorophenyl)methylcarbamothioyl]furan-2-carboxamide
CID 17194361
3-(2-chlorophenyl)-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]propanamide
CID 43005118
N-[4-[2-[2-(4-chlorophenyl)acetyl]hydrazinyl]-4-oxobutyl]furan-2-carboxamide
CID 31727361

Frequently Asked Questions

What is the IUPAC name of N'-[3-(2-chlorophenyl)propanoyl]furan-2-carbohydrazide?
The IUPAC name of N'-[3-(2-chlorophenyl)propanoyl]furan-2-carbohydrazide (CID 29436828) is N'-[3-(2-chlorophenyl)propanoyl]furan-2-carbohydrazide.
What is the SMILES notation for N'-[3-(2-chlorophenyl)propanoyl]furan-2-carbohydrazide?
The canonical SMILES for N'-[3-(2-chlorophenyl)propanoyl]furan-2-carbohydrazide is O=C(CCc1ccccc1Cl)NNC(=O)c1ccco1.
What is the InChIKey of N'-[3-(2-chlorophenyl)propanoyl]furan-2-carbohydrazide?
The InChIKey is VKSJRUXRYBTENV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClN2O3/c15-11-5-2-1-4-10(11)7-8-13(18)16-17-14(19)12-6-3-9-20-12/h1-6,9H,7-8H2,(H,16,18)(H,17,19).
What are the key properties of N'-[3-(2-chlorophenyl)propanoyl]furan-2-carbohydrazide?
N'-[3-(2-chlorophenyl)propanoyl]furan-2-carbohydrazide has a molecular weight of 292.72 g/mol, XLogP of 2.33, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[3-(2-chlorophenyl)propanoyl]furan-2-carbohydrazide is sourced from PubChem (CID 29436828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).