N-(3-ethylcyclohexyl)-2-hydrazinylbenzamide

C15H23N3O — CID 64750344

IUPACN-(3-ethylcyclohexyl)-2-hydrazinylbenzamide
SMILESCCC1CCCC(NC(=O)c2ccccc2NN)C1
InChIInChI=1S/C15H23N3O/c1-2-11-6-5-7-12(10-11)17-15(19)13-8-3-4-9-14(13)18-16/h3-4,8-9,11-12,18H,2,5-7,10,16H2,1H3,(H,17,19)
InChIKeyFJFDBIXLINKGKV-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.67
Rot. Bonds4

About N-(3-ethylcyclohexyl)-2-hydrazinylbenzamide

N-(3-ethylcyclohexyl)-2-hydrazinylbenzamide (PubChem CID 64750344) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is N-(3-ethylcyclohexyl)-2-hydrazinylbenzamide.

Molecular Properties

Compound NameN-(3-ethylcyclohexyl)-2-hydrazinylbenzamide
PubChem CID64750344
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC NameN-(3-ethylcyclohexyl)-2-hydrazinylbenzamide
SMILESCCC1CCCC(NC(=O)c2ccccc2NN)C1
InChIInChI=1S/C15H23N3O/c1-2-11-6-5-7-12(10-11)17-15(19)13-8-3-4-9-14(13)18-16/h3-4,8-9,11-12,18H,2,5-7,10,16H2,1H3,(H,17,19)
InChIKeyFJFDBIXLINKGKV-UHFFFAOYSA-N
XLogP2.67
TPSA67.15 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.67
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(3-ethylcyclohexyl)-2-hydrazinylbenzamide?
The IUPAC name of N-(3-ethylcyclohexyl)-2-hydrazinylbenzamide (CID 64750344) is N-(3-ethylcyclohexyl)-2-hydrazinylbenzamide.
What is the SMILES notation for N-(3-ethylcyclohexyl)-2-hydrazinylbenzamide?
The canonical SMILES for N-(3-ethylcyclohexyl)-2-hydrazinylbenzamide is CCC1CCCC(NC(=O)c2ccccc2NN)C1.
What is the InChIKey of N-(3-ethylcyclohexyl)-2-hydrazinylbenzamide?
The InChIKey is FJFDBIXLINKGKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-2-11-6-5-7-12(10-11)17-15(19)13-8-3-4-9-14(13)18-16/h3-4,8-9,11-12,18H,2,5-7,10,16H2,1H3,(H,17,19).
What are the key properties of N-(3-ethylcyclohexyl)-2-hydrazinylbenzamide?
N-(3-ethylcyclohexyl)-2-hydrazinylbenzamide has a molecular weight of 261.37 g/mol, XLogP of 2.67, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethylcyclohexyl)-2-hydrazinylbenzamide is sourced from PubChem (CID 64750344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).