N-(2,3-dimethylcyclohexyl)-4-hydrazinyl-3-methylbenzamide

C16H25N3O — CID 63211656

IUPACN-(2,3-dimethylcyclohexyl)-4-hydrazinyl-3-methylbenzamide
SMILESCc1cc(C(=O)NC2CCCC(C)C2C)ccc1NN
InChIInChI=1S/C16H25N3O/c1-10-5-4-6-15(12(10)3)18-16(20)13-7-8-14(19-17)11(2)9-13/h7-10,12,15,19H,4-6,17H2,1-3H3,(H,18,20)
InChIKeyFPEKNXYYMWORTC-UHFFFAOYSA-N
MW275.40 g/mol
LogP2.84
Rot. Bonds3

About N-(2,3-dimethylcyclohexyl)-4-hydrazinyl-3-methylbenzamide

N-(2,3-dimethylcyclohexyl)-4-hydrazinyl-3-methylbenzamide (PubChem CID 63211656) has the molecular formula C16H25N3O and a molecular weight of 275.40 g/mol. Its IUPAC name is N-(2,3-dimethylcyclohexyl)-4-hydrazinyl-3-methylbenzamide.

Molecular Properties

Compound NameN-(2,3-dimethylcyclohexyl)-4-hydrazinyl-3-methylbenzamide
PubChem CID63211656
Molecular FormulaC16H25N3O
Molecular Weight275.40 g/mol
Exact Mass275.20
IUPAC NameN-(2,3-dimethylcyclohexyl)-4-hydrazinyl-3-methylbenzamide
SMILESCc1cc(C(=O)NC2CCCC(C)C2C)ccc1NN
InChIInChI=1S/C16H25N3O/c1-10-5-4-6-15(12(10)3)18-16(20)13-7-8-14(19-17)11(2)9-13/h7-10,12,15,19H,4-6,17H2,1-3H3,(H,18,20)
InChIKeyFPEKNXYYMWORTC-UHFFFAOYSA-N
XLogP2.84
TPSA67.15 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 52.84
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

4-amino-N-(2,3-dimethylcyclohexyl)-3-methylbenzamide
CID 16785407
N-(2,3-dimethylcyclohexyl)-3,4-dihydroxybenzamide
CID 103955392
4-amino-N-(2,3-dimethylcyclohexyl)benzamide;hydrochloride
CID 119676181
4-acetyl-N-(2,3-dimethylcyclohexyl)benzamide
CID 126843777
4-hydroxy-3-methyl-N-(2-methylcyclopentyl)benzamide
CID 113358322
4-amino-3-methyl-N-[(1R,2R)-2-methylcyclohexyl]benzamide
CID 30117194
N-[(1S,2R,3S)-2,3-dimethylcyclohexyl]-4-iodobenzamide
CID 11919878
3-chloro-N-(2,3-dimethylcyclohexyl)-4-iodobenzamide
CID 103221060
2-amino-N-(2,3-dimethylcyclohexyl)pyridine-4-carboxamide
CID 62156414
N-(2,3-dimethylcyclohexyl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide
CID 25162668
N-(2,3-dimethylcyclohexyl)-4-hydroxy-2-methylbenzamide
CID 103863506
N,3-dimethyl-4-[(2-methylcyclopentyl)amino]benzamide
CID 65044342

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylcyclohexyl)-4-hydrazinyl-3-methylbenzamide?
The IUPAC name of N-(2,3-dimethylcyclohexyl)-4-hydrazinyl-3-methylbenzamide (CID 63211656) is N-(2,3-dimethylcyclohexyl)-4-hydrazinyl-3-methylbenzamide.
What is the SMILES notation for N-(2,3-dimethylcyclohexyl)-4-hydrazinyl-3-methylbenzamide?
The canonical SMILES for N-(2,3-dimethylcyclohexyl)-4-hydrazinyl-3-methylbenzamide is Cc1cc(C(=O)NC2CCCC(C)C2C)ccc1NN.
What is the InChIKey of N-(2,3-dimethylcyclohexyl)-4-hydrazinyl-3-methylbenzamide?
The InChIKey is FPEKNXYYMWORTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O/c1-10-5-4-6-15(12(10)3)18-16(20)13-7-8-14(19-17)11(2)9-13/h7-10,12,15,19H,4-6,17H2,1-3H3,(H,18,20).
What are the key properties of N-(2,3-dimethylcyclohexyl)-4-hydrazinyl-3-methylbenzamide?
N-(2,3-dimethylcyclohexyl)-4-hydrazinyl-3-methylbenzamide has a molecular weight of 275.40 g/mol, XLogP of 2.84, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylcyclohexyl)-4-hydrazinyl-3-methylbenzamide is sourced from PubChem (CID 63211656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).