2-cyclohexyl-N-[(1R)-2-methoxy-1-phenylethyl]ethanimine

C17H25NO — CID 11054383

IUPAC2-cyclohexyl-N-[(1R)-2-methoxy-1-phenylethyl]ethanimine
SMILESCOC[C@H](/N=C/CC1CCCCC1)c1ccccc1
InChIInChI=1S/C17H25NO/c1-19-14-17(16-10-6-3-7-11-16)18-13-12-15-8-4-2-5-9-15/h3,6-7,10-11,13,15,17H,2,4-5,8-9,12,14H2,1H3/b18-13+/t17-/m0/s1
InChIKeyDLQHKKZNTQBFQT-NAVNFMRLSA-N
MW259.39 g/mol
LogP4.42
Rot. Bonds6

About 2-cyclohexyl-N-[(1R)-2-methoxy-1-phenylethyl]ethanimine

2-cyclohexyl-N-[(1R)-2-methoxy-1-phenylethyl]ethanimine (PubChem CID 11054383) has the molecular formula C17H25NO and a molecular weight of 259.39 g/mol. Its IUPAC name is 2-cyclohexyl-N-[(1R)-2-methoxy-1-phenylethyl]ethanimine.

Molecular Properties

Compound Name2-cyclohexyl-N-[(1R)-2-methoxy-1-phenylethyl]ethanimine
PubChem CID11054383
Molecular FormulaC17H25NO
Molecular Weight259.39 g/mol
Exact Mass259.19
IUPAC Name2-cyclohexyl-N-[(1R)-2-methoxy-1-phenylethyl]ethanimine
SMILESCOC[C@H](/N=C/CC1CCCCC1)c1ccccc1
InChIInChI=1S/C17H25NO/c1-19-14-17(16-10-6-3-7-11-16)18-13-12-15-8-4-2-5-9-15/h3,6-7,10-11,13,15,17H,2,4-5,8-9,12,14H2,1H3/b18-13+/t17-/m0/s1
InChIKeyDLQHKKZNTQBFQT-NAVNFMRLSA-N
XLogP4.42
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.39
LogP ≤ 54.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze 2-cyclohexyl-N-[(1R)-2-methoxy-1-phenylethyl]ethanimine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(S,S)-2,2'-Isopropylidenebis(4-phenyl-2-oxazoline)
CID 676388
Ph-box, (R,R)-
CID 676390
(S,S)-2,2'-Methylenebis(4-phenyl-2-oxazoline)
CID 736684
2,2'-(Propane-2,2-diyl)bis(4-phenyl-4,5-dihydrooxazole)
CID 3957686
2,2,2-trifluoro-N-[(1R)-2-methoxy-1-phenylethyl]ethanimine
CID 11229989
(4R)-4-phenyl-2-(4,4,4-trifluoro-3-methylbutyl)-4,5-dihydro-1,3-oxazole
CID 134858563
2,2,2-trifluoro-N-[(1S)-2-methoxy-1-phenylethyl]ethanimine oxide
CID 139191316
(4S,4'S)-2,2'-(Cyclopropane-1,1-diyl)bis(4-phenyl-4,5-dihydrooxazole)
CID 10496806
(4S,5R)-5-methyl-2-[2-[(4S,5R)-5-methyl-4-phenyl-4,5-dihydro-1,3-oxazol-2-yl]propan-2-yl]-4-phenyl-4,5-dihydro-1,3-oxazole
CID 10546604
(betaR)-beta-[(Phenylmethylene)amino]benzeneethanol
CID 10911227
(4R)-2-methyl-4-phenyl-4,5-dihydro-1,3-oxazole
CID 10931742
2H-1,4-Oxazin-2-one, 5,6-dihydro-5-phenyl-, (5S)-
CID 10942968

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-N-[(1R)-2-methoxy-1-phenylethyl]ethanimine?
The IUPAC name of 2-cyclohexyl-N-[(1R)-2-methoxy-1-phenylethyl]ethanimine (CID 11054383) is 2-cyclohexyl-N-[(1R)-2-methoxy-1-phenylethyl]ethanimine.
What is the SMILES notation for 2-cyclohexyl-N-[(1R)-2-methoxy-1-phenylethyl]ethanimine?
The canonical SMILES for 2-cyclohexyl-N-[(1R)-2-methoxy-1-phenylethyl]ethanimine is COC[C@H](/N=C/CC1CCCCC1)c1ccccc1.
What is the InChIKey of 2-cyclohexyl-N-[(1R)-2-methoxy-1-phenylethyl]ethanimine?
The InChIKey is DLQHKKZNTQBFQT-NAVNFMRLSA-N. The full InChI is InChI=1S/C17H25NO/c1-19-14-17(16-10-6-3-7-11-16)18-13-12-15-8-4-2-5-9-15/h3,6-7,10-11,13,15,17H,2,4-5,8-9,12,14H2,1H3/b18-13+/t17-/m0/s1.
What are the key properties of 2-cyclohexyl-N-[(1R)-2-methoxy-1-phenylethyl]ethanimine?
2-cyclohexyl-N-[(1R)-2-methoxy-1-phenylethyl]ethanimine has a molecular weight of 259.39 g/mol, XLogP of 4.42, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-N-[(1R)-2-methoxy-1-phenylethyl]ethanimine is sourced from PubChem (CID 11054383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).