1-(4-chlorophenyl)-2-(1-naphthalen-1-ylethylamino)ethanol

C20H20ClNO — CID 42942251

IUPAC1-(4-chlorophenyl)-2-(1-naphthalen-1-ylethylamino)ethanol
SMILESCC(NCC(O)c1ccc(Cl)cc1)c1cccc2ccccc12
InChIInChI=1S/C20H20ClNO/c1-14(18-8-4-6-15-5-2-3-7-19(15)18)22-13-20(23)16-9-11-17(21)12-10-16/h2-12,14,20,22-23H,13H2,1H3
InChIKeyXZJTZGSDLROZNL-UHFFFAOYSA-N
MW325.84 g/mol
LogP4.88
Rot. Bonds5

About 1-(4-chlorophenyl)-2-(1-naphthalen-1-ylethylamino)ethanol

1-(4-chlorophenyl)-2-(1-naphthalen-1-ylethylamino)ethanol (PubChem CID 42942251) has the molecular formula C20H20ClNO and a molecular weight of 325.84 g/mol. Its IUPAC name is 1-(4-chlorophenyl)-2-(1-naphthalen-1-ylethylamino)ethanol.

Molecular Properties

Compound Name1-(4-chlorophenyl)-2-(1-naphthalen-1-ylethylamino)ethanol
PubChem CID42942251
Molecular FormulaC20H20ClNO
Molecular Weight325.84 g/mol
Exact Mass325.12
IUPAC Name1-(4-chlorophenyl)-2-(1-naphthalen-1-ylethylamino)ethanol
SMILESCC(NCC(O)c1ccc(Cl)cc1)c1cccc2ccccc12
InChIInChI=1S/C20H20ClNO/c1-14(18-8-4-6-15-5-2-3-7-19(15)18)22-13-20(23)16-9-11-17(21)12-10-16/h2-12,14,20,22-23H,13H2,1H3
InChIKeyXZJTZGSDLROZNL-UHFFFAOYSA-N
XLogP4.88
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.84
LogP ≤ 54.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-chlorophenyl)-2-[[(1R)-1-phenylethyl]amino]ethanol
CID 78953095
1-(6-methyl-3-pyridinyl)-2-[[(1R)-1-naphthalen-1-ylethyl]amino]ethanol
CID 167942481
3-methyl-1-(1-naphthalen-1-ylethylamino)butan-2-ol
CID 115677077
(S)-(4-chlorophenyl)-naphthalen-1-ylmethanol
CID 93489560
(1S)-1-(4-chlorophenyl)-2-(propan-2-ylamino)ethanol
CID 42553219
1-(4-chlorophenyl)-2-[[(1S)-1-(3-methylphenyl)ethyl]amino]ethanol
CID 81360889
2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]-1-(4-methoxyphenyl)ethanol
CID 81356620
1-(4-chlorophenyl)-2-[[(1R)-1-pyridin-2-ylethyl]amino]ethanol
CID 81406911
N-[(4-chlorophenyl)methyl]-2-[[(1R)-1-naphthalen-1-ylethyl]amino]acetamide
CID 9396902
2-[1-(4-chlorophenyl)ethylamino]-1-(4-fluorophenyl)ethanol
CID 60714730
2-methyl-N-(1-naphthalen-1-ylethyl)butan-1-amine
CID 43094255
2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]-1-(2,6-difluorophenyl)ethanol
CID 81356349

Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)-2-(1-naphthalen-1-ylethylamino)ethanol?
The IUPAC name of 1-(4-chlorophenyl)-2-(1-naphthalen-1-ylethylamino)ethanol (CID 42942251) is 1-(4-chlorophenyl)-2-(1-naphthalen-1-ylethylamino)ethanol.
What is the SMILES notation for 1-(4-chlorophenyl)-2-(1-naphthalen-1-ylethylamino)ethanol?
The canonical SMILES for 1-(4-chlorophenyl)-2-(1-naphthalen-1-ylethylamino)ethanol is CC(NCC(O)c1ccc(Cl)cc1)c1cccc2ccccc12.
What is the InChIKey of 1-(4-chlorophenyl)-2-(1-naphthalen-1-ylethylamino)ethanol?
The InChIKey is XZJTZGSDLROZNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20ClNO/c1-14(18-8-4-6-15-5-2-3-7-19(15)18)22-13-20(23)16-9-11-17(21)12-10-16/h2-12,14,20,22-23H,13H2,1H3.
What are the key properties of 1-(4-chlorophenyl)-2-(1-naphthalen-1-ylethylamino)ethanol?
1-(4-chlorophenyl)-2-(1-naphthalen-1-ylethylamino)ethanol has a molecular weight of 325.84 g/mol, XLogP of 4.88, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)-2-(1-naphthalen-1-ylethylamino)ethanol is sourced from PubChem (CID 42942251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).