N'-[2-(4-chlorophenyl)acetyl]cyclopentanecarbohydrazide

C14H17ClN2O2 — CID 26657650

IUPACN'-[2-(4-chlorophenyl)acetyl]cyclopentanecarbohydrazide
SMILESO=C(Cc1ccc(Cl)cc1)NNC(=O)C1CCCC1
InChIInChI=1S/C14H17ClN2O2/c15-12-7-5-10(6-8-12)9-13(18)16-17-14(19)11-3-1-2-4-11/h5-8,11H,1-4,9H2,(H,16,18)(H,17,19)
InChIKeyBEJAVHRYQNXWBE-UHFFFAOYSA-N
MW280.75 g/mol
LogP2.22
Rot. Bonds3

About N'-[2-(4-chlorophenyl)acetyl]cyclopentanecarbohydrazide

N'-[2-(4-chlorophenyl)acetyl]cyclopentanecarbohydrazide (PubChem CID 26657650) has the molecular formula C14H17ClN2O2 and a molecular weight of 280.75 g/mol. Its IUPAC name is N'-[2-(4-chlorophenyl)acetyl]cyclopentanecarbohydrazide.

Molecular Properties

Compound NameN'-[2-(4-chlorophenyl)acetyl]cyclopentanecarbohydrazide
PubChem CID26657650
Molecular FormulaC14H17ClN2O2
Molecular Weight280.75 g/mol
Exact Mass280.10
IUPAC NameN'-[2-(4-chlorophenyl)acetyl]cyclopentanecarbohydrazide
SMILESO=C(Cc1ccc(Cl)cc1)NNC(=O)C1CCCC1
InChIInChI=1S/C14H17ClN2O2/c15-12-7-5-10(6-8-12)9-13(18)16-17-14(19)11-3-1-2-4-11/h5-8,11H,1-4,9H2,(H,16,18)(H,17,19)
InChIKeyBEJAVHRYQNXWBE-UHFFFAOYSA-N
XLogP2.22
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.75
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N'-[2-(4-chlorophenyl)acetyl]cyclopentanecarbohydrazide?
The IUPAC name of N'-[2-(4-chlorophenyl)acetyl]cyclopentanecarbohydrazide (CID 26657650) is N'-[2-(4-chlorophenyl)acetyl]cyclopentanecarbohydrazide.
What is the SMILES notation for N'-[2-(4-chlorophenyl)acetyl]cyclopentanecarbohydrazide?
The canonical SMILES for N'-[2-(4-chlorophenyl)acetyl]cyclopentanecarbohydrazide is O=C(Cc1ccc(Cl)cc1)NNC(=O)C1CCCC1.
What is the InChIKey of N'-[2-(4-chlorophenyl)acetyl]cyclopentanecarbohydrazide?
The InChIKey is BEJAVHRYQNXWBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17ClN2O2/c15-12-7-5-10(6-8-12)9-13(18)16-17-14(19)11-3-1-2-4-11/h5-8,11H,1-4,9H2,(H,16,18)(H,17,19).
What are the key properties of N'-[2-(4-chlorophenyl)acetyl]cyclopentanecarbohydrazide?
N'-[2-(4-chlorophenyl)acetyl]cyclopentanecarbohydrazide has a molecular weight of 280.75 g/mol, XLogP of 2.22, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(4-chlorophenyl)acetyl]cyclopentanecarbohydrazide is sourced from PubChem (CID 26657650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).