(2R)-2-[(4-chlorophenyl)methylideneamino]-2-phenylethanol

C15H14ClNO — CID 11253959

IUPAC(2R)-2-[(4-chlorophenyl)methylideneamino]-2-phenylethanol
SMILESOC[C@H](/N=C/c1ccc(Cl)cc1)c1ccccc1
InChIInChI=1S/C15H14ClNO/c16-14-8-6-12(7-9-14)10-17-15(11-18)13-4-2-1-3-5-13/h1-10,15,18H,11H2/b17-10+/t15-/m0/s1
InChIKeyGLFKEXLRGQSSSA-ADFUCPMPSA-N
MW259.74 g/mol
LogP3.49
Rot. Bonds4

About (2R)-2-[(4-chlorophenyl)methylideneamino]-2-phenylethanol

(2R)-2-[(4-chlorophenyl)methylideneamino]-2-phenylethanol (PubChem CID 11253959) has the molecular formula C15H14ClNO and a molecular weight of 259.74 g/mol. Its IUPAC name is (2R)-2-[(4-chlorophenyl)methylideneamino]-2-phenylethanol.

Molecular Properties

Compound Name(2R)-2-[(4-chlorophenyl)methylideneamino]-2-phenylethanol
PubChem CID11253959
Molecular FormulaC15H14ClNO
Molecular Weight259.74 g/mol
Exact Mass259.08
IUPAC Name(2R)-2-[(4-chlorophenyl)methylideneamino]-2-phenylethanol
SMILESOC[C@H](/N=C/c1ccc(Cl)cc1)c1ccccc1
InChIInChI=1S/C15H14ClNO/c16-14-8-6-12(7-9-14)10-17-15(11-18)13-4-2-1-3-5-13/h1-10,15,18H,11H2/b17-10+/t15-/m0/s1
InChIKeyGLFKEXLRGQSSSA-ADFUCPMPSA-N
XLogP3.49
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.74
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(E)-1-(4-chlorophenyl)-N-[[(E)-(4-chlorophenyl)methylideneamino]-phenylmethyl]methanimine
CID 24721019
2-[[6-[(2-hydroxy-1-phenylethyl)iminomethyl]-2-pyridinyl]methylideneamino]-2-phenylethanol
CID 4086151
ethyl 2-[(4-chlorophenyl)methylideneamino]-2-phenylacetate
CID 10662075
CID 10914573
CID 10914573
4-[[(1S)-1-phenylpropyl]iminomethyl]phenol
CID 135750361
2,6-bis[[(1R)-2-hydroxy-1-phenylethyl]iminomethyl]-4-methylphenol
CID 136883517
2-[(2-hydroxy-1-phenylethyl)iminomethyl]pyridin-3-ol
CID 137254256
1-(4-chlorophenyl)-N-propan-2-ylmethanimine
CID 11622447
1-[(2-hydroxy-1-phenylethyl)iminomethyl]naphthalen-2-ol
CID 136843980
methyl 2-[(4-chlorophenyl)methylideneamino]-3-hydroxypropanoate
CID 86171147
1-benzhydryl-4-chlorobenzene
CID 13050205
2-[1-(4-chlorophenyl)-2-hydroxyethyl]guanidine
CID 130927020

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[(4-chlorophenyl)methylideneamino]-2-phenylethanol?
The IUPAC name of (2R)-2-[(4-chlorophenyl)methylideneamino]-2-phenylethanol (CID 11253959) is (2R)-2-[(4-chlorophenyl)methylideneamino]-2-phenylethanol.
What is the SMILES notation for (2R)-2-[(4-chlorophenyl)methylideneamino]-2-phenylethanol?
The canonical SMILES for (2R)-2-[(4-chlorophenyl)methylideneamino]-2-phenylethanol is OC[C@H](/N=C/c1ccc(Cl)cc1)c1ccccc1.
What is the InChIKey of (2R)-2-[(4-chlorophenyl)methylideneamino]-2-phenylethanol?
The InChIKey is GLFKEXLRGQSSSA-ADFUCPMPSA-N. The full InChI is InChI=1S/C15H14ClNO/c16-14-8-6-12(7-9-14)10-17-15(11-18)13-4-2-1-3-5-13/h1-10,15,18H,11H2/b17-10+/t15-/m0/s1.
What are the key properties of (2R)-2-[(4-chlorophenyl)methylideneamino]-2-phenylethanol?
(2R)-2-[(4-chlorophenyl)methylideneamino]-2-phenylethanol has a molecular weight of 259.74 g/mol, XLogP of 3.49, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[(4-chlorophenyl)methylideneamino]-2-phenylethanol is sourced from PubChem (CID 11253959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).