N-[(4-ethylcyclohexyl)methyl]-2-hydrazinylbenzamide

C16H25N3O — CID 62241479

IUPACN-[(4-ethylcyclohexyl)methyl]-2-hydrazinylbenzamide
SMILESCCC1CCC(CNC(=O)c2ccccc2NN)CC1
InChIInChI=1S/C16H25N3O/c1-2-12-7-9-13(10-8-12)11-18-16(20)14-5-3-4-6-15(14)19-17/h3-6,12-13,19H,2,7-11,17H2,1H3,(H,18,20)
InChIKeyWJFYGEBNOISFML-UHFFFAOYSA-N
MW275.40 g/mol
LogP2.92
Rot. Bonds5

About N-[(4-ethylcyclohexyl)methyl]-2-hydrazinylbenzamide

N-[(4-ethylcyclohexyl)methyl]-2-hydrazinylbenzamide (PubChem CID 62241479) has the molecular formula C16H25N3O and a molecular weight of 275.40 g/mol. Its IUPAC name is N-[(4-ethylcyclohexyl)methyl]-2-hydrazinylbenzamide.

Molecular Properties

Compound NameN-[(4-ethylcyclohexyl)methyl]-2-hydrazinylbenzamide
PubChem CID62241479
Molecular FormulaC16H25N3O
Molecular Weight275.40 g/mol
Exact Mass275.20
IUPAC NameN-[(4-ethylcyclohexyl)methyl]-2-hydrazinylbenzamide
SMILESCCC1CCC(CNC(=O)c2ccccc2NN)CC1
InChIInChI=1S/C16H25N3O/c1-2-12-7-9-13(10-8-12)11-18-16(20)14-5-3-4-6-15(14)19-17/h3-6,12-13,19H,2,7-11,17H2,1H3,(H,18,20)
InChIKeyWJFYGEBNOISFML-UHFFFAOYSA-N
XLogP2.92
TPSA67.15 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 52.92
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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Related Compounds

N-(cyclopropylmethyl)-2-(propan-2-ylamino)benzamide
CID 63107544
2-(ethylamino)-N-[(4-methylcyclohexyl)methyl]benzamide
CID 63244405
N-[(4-methylcyclohexyl)methyl]-2-(propylamino)benzamide
CID 63501540
N-[(4-ethylcyclohexyl)methyl]-2-fluoro-3-methylbenzamide
CID 81480761
2-hydrazinyl-N-propylbenzamide
CID 62238054
N-(3-ethylcyclohexyl)-2-hydrazinylbenzamide
CID 64750344
2-hydrazinyl-N-(thiolan-2-ylmethyl)benzamide
CID 80586168
N-(cyclopropylmethyl)-3-fluoro-2-hydrazinylbenzamide
CID 62660969
N-(cyclopropylmethyl)-2-sulfamoylbenzamide
CID 43164725
N-[(4-ethylcyclohexyl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide
CID 136524835
2-amino-N-[(4-ethylcyclohexyl)methyl]-4-methoxybenzamide
CID 115412843
2-chloro-N-[(4-ethylcyclohexyl)methyl]-5-sulfanylbenzamide
CID 107027247

Frequently Asked Questions

What is the IUPAC name of N-[(4-ethylcyclohexyl)methyl]-2-hydrazinylbenzamide?
The IUPAC name of N-[(4-ethylcyclohexyl)methyl]-2-hydrazinylbenzamide (CID 62241479) is N-[(4-ethylcyclohexyl)methyl]-2-hydrazinylbenzamide.
What is the SMILES notation for N-[(4-ethylcyclohexyl)methyl]-2-hydrazinylbenzamide?
The canonical SMILES for N-[(4-ethylcyclohexyl)methyl]-2-hydrazinylbenzamide is CCC1CCC(CNC(=O)c2ccccc2NN)CC1.
What is the InChIKey of N-[(4-ethylcyclohexyl)methyl]-2-hydrazinylbenzamide?
The InChIKey is WJFYGEBNOISFML-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O/c1-2-12-7-9-13(10-8-12)11-18-16(20)14-5-3-4-6-15(14)19-17/h3-6,12-13,19H,2,7-11,17H2,1H3,(H,18,20).
What are the key properties of N-[(4-ethylcyclohexyl)methyl]-2-hydrazinylbenzamide?
N-[(4-ethylcyclohexyl)methyl]-2-hydrazinylbenzamide has a molecular weight of 275.40 g/mol, XLogP of 2.92, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-ethylcyclohexyl)methyl]-2-hydrazinylbenzamide is sourced from PubChem (CID 62241479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).