2-anilino-1-(4-chlorophenyl)ethanol

C14H14ClNO — CID 13416404

IUPAC2-anilino-1-(4-chlorophenyl)ethanol
SMILESOC(CNc1ccccc1)c1ccc(Cl)cc1
InChIInChI=1S/C14H14ClNO/c15-12-8-6-11(7-9-12)14(17)10-16-13-4-2-1-3-5-13/h1-9,14,16-17H,10H2
InChIKeyNVCBYZAHNRTUQH-UHFFFAOYSA-N
MW247.73 g/mol
LogP3.49
Rot. Bonds4

About 2-anilino-1-(4-chlorophenyl)ethanol

2-anilino-1-(4-chlorophenyl)ethanol (PubChem CID 13416404) has the molecular formula C14H14ClNO and a molecular weight of 247.73 g/mol. Its IUPAC name is 2-anilino-1-(4-chlorophenyl)ethanol.

Molecular Properties

Compound Name2-anilino-1-(4-chlorophenyl)ethanol
PubChem CID13416404
Molecular FormulaC14H14ClNO
Molecular Weight247.73 g/mol
Exact Mass247.08
IUPAC Name2-anilino-1-(4-chlorophenyl)ethanol
SMILESOC(CNc1ccccc1)c1ccc(Cl)cc1
InChIInChI=1S/C14H14ClNO/c15-12-8-6-11(7-9-12)14(17)10-16-13-4-2-1-3-5-13/h1-9,14,16-17H,10H2
InChIKeyNVCBYZAHNRTUQH-UHFFFAOYSA-N
XLogP3.49
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.73
LogP ≤ 53.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-(2-anilino-1-hydroxyethyl)phenol
CID 11701381
2-(3-bromoanilino)-1-(4-chlorophenyl)ethanol
CID 60724934
2-(3-chloro-4-fluoroanilino)-1-phenylethanol
CID 82045081
1-(4-chlorophenyl)-2-(3,4-dichloroanilino)ethanol
CID 60724810
2-(4-chloroanilino)-1-(3,4-difluorophenyl)ethanol
CID 60898138
1-(4-chlorophenyl)-2-(4-propan-2-yloxyanilino)ethanol
CID 60902136
2-(3-chloroanilino)-1-(4-propan-2-ylphenyl)ethanol
CID 60897560
1-(4-chlorophenyl)-2-(2-methylsulfanylanilino)ethanol
CID 107644582
1-(4-chlorophenyl)-2-(1-phenylpropylamino)ethanol
CID 62304367
4-[1-hydroxy-2-(4-phenylanilino)ethyl]phenol
CID 11551259
1-(4-chlorophenyl)-2-[[(1R)-1-phenylethyl]amino]ethanol
CID 78953095
2-(4-aminoanilino)-1-(4-phenylphenyl)ethanol
CID 155758987

Frequently Asked Questions

What is the IUPAC name of 2-anilino-1-(4-chlorophenyl)ethanol?
The IUPAC name of 2-anilino-1-(4-chlorophenyl)ethanol (CID 13416404) is 2-anilino-1-(4-chlorophenyl)ethanol.
What is the SMILES notation for 2-anilino-1-(4-chlorophenyl)ethanol?
The canonical SMILES for 2-anilino-1-(4-chlorophenyl)ethanol is OC(CNc1ccccc1)c1ccc(Cl)cc1.
What is the InChIKey of 2-anilino-1-(4-chlorophenyl)ethanol?
The InChIKey is NVCBYZAHNRTUQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClNO/c15-12-8-6-11(7-9-12)14(17)10-16-13-4-2-1-3-5-13/h1-9,14,16-17H,10H2.
What are the key properties of 2-anilino-1-(4-chlorophenyl)ethanol?
2-anilino-1-(4-chlorophenyl)ethanol has a molecular weight of 247.73 g/mol, XLogP of 3.49, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-anilino-1-(4-chlorophenyl)ethanol is sourced from PubChem (CID 13416404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).