N'-[(1R,2S)-2-phenylcyclohexyl]benzohydrazide

C19H22N2O — CID 125468545

IUPACN'-[(1R,2S)-2-phenylcyclohexyl]benzohydrazide
SMILESO=C(NN[C@@H]1CCCC[C@H]1c1ccccc1)c1ccccc1
InChIInChI=1S/C19H22N2O/c22-19(16-11-5-2-6-12-16)21-20-18-14-8-7-13-17(18)15-9-3-1-4-10-15/h1-6,9-12,17-18,20H,7-8,13-14H2,(H,21,22)/t17-,18+/m0/s1
InChIKeyNWEGMFWSFUPIKN-ZWKOTPCHSA-N
MW294.40 g/mol
LogP3.65
Rot. Bonds4

About N'-[(1R,2S)-2-phenylcyclohexyl]benzohydrazide

N'-[(1R,2S)-2-phenylcyclohexyl]benzohydrazide (PubChem CID 125468545) has the molecular formula C19H22N2O and a molecular weight of 294.40 g/mol. Its IUPAC name is N'-[(1R,2S)-2-phenylcyclohexyl]benzohydrazide.

Molecular Properties

Compound NameN'-[(1R,2S)-2-phenylcyclohexyl]benzohydrazide
PubChem CID125468545
Molecular FormulaC19H22N2O
Molecular Weight294.40 g/mol
Exact Mass294.17
IUPAC NameN'-[(1R,2S)-2-phenylcyclohexyl]benzohydrazide
SMILESO=C(NN[C@@H]1CCCC[C@H]1c1ccccc1)c1ccccc1
InChIInChI=1S/C19H22N2O/c22-19(16-11-5-2-6-12-16)21-20-18-14-8-7-13-17(18)15-9-3-1-4-10-15/h1-6,9-12,17-18,20H,7-8,13-14H2,(H,21,22)/t17-,18+/m0/s1
InChIKeyNWEGMFWSFUPIKN-ZWKOTPCHSA-N
XLogP3.65
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.40
LogP ≤ 53.65
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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Related Compounds

[(2S)-2-phenylcyclohexyl]urea
CID 141176309
2-methyl-N-[(1R)-2-phenylcyclohexyl]propanamide
CID 170769324
N-[(1S,2S)-2-phenylcyclopentyl]cyclohexanecarboxamide
CID 67394032
3-[(2-phenylcyclohexyl)amino]propanoic acid
CID 43774837
N-[(1S,2R)-2-phenylcyclopropyl]benzamide
CID 7350127
4-[(2-phenylcyclohexyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 120673133
methyl (2S)-3-methyl-2-[(2-phenylcyclohexyl)amino]butanoate
CID 43776131
N'-[(2R,4aR,8aS)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl]benzohydrazide
CID 129440770
4-[2-hydroxyethyl(methyl)amino]-N-[(1R,2S)-2-phenylcyclohexyl]benzamide
CID 91843146
N-[(1S,2R)-2-aminocyclohexyl]benzamide
CID 15151854
N-[(1S,2S)-2-aminocyclohexyl]benzamide
CID 15151853
N-[(1R)-2-methylcyclohexyl]benzamide
CID 137472316

Frequently Asked Questions

What is the IUPAC name of N'-[(1R,2S)-2-phenylcyclohexyl]benzohydrazide?
The IUPAC name of N'-[(1R,2S)-2-phenylcyclohexyl]benzohydrazide (CID 125468545) is N'-[(1R,2S)-2-phenylcyclohexyl]benzohydrazide.
What is the SMILES notation for N'-[(1R,2S)-2-phenylcyclohexyl]benzohydrazide?
The canonical SMILES for N'-[(1R,2S)-2-phenylcyclohexyl]benzohydrazide is O=C(NN[C@@H]1CCCC[C@H]1c1ccccc1)c1ccccc1.
What is the InChIKey of N'-[(1R,2S)-2-phenylcyclohexyl]benzohydrazide?
The InChIKey is NWEGMFWSFUPIKN-ZWKOTPCHSA-N. The full InChI is InChI=1S/C19H22N2O/c22-19(16-11-5-2-6-12-16)21-20-18-14-8-7-13-17(18)15-9-3-1-4-10-15/h1-6,9-12,17-18,20H,7-8,13-14H2,(H,21,22)/t17-,18+/m0/s1.
What are the key properties of N'-[(1R,2S)-2-phenylcyclohexyl]benzohydrazide?
N'-[(1R,2S)-2-phenylcyclohexyl]benzohydrazide has a molecular weight of 294.40 g/mol, XLogP of 3.65, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[(1R,2S)-2-phenylcyclohexyl]benzohydrazide is sourced from PubChem (CID 125468545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).