2-[[(4-methoxyphenyl)-(4-methylphenyl)methyl]amino]ethanol

C17H21NO2 — CID 75482273

IUPAC2-[[(4-methoxyphenyl)-(4-methylphenyl)methyl]amino]ethanol
SMILESCOc1ccc(C(NCCO)c2ccc(C)cc2)cc1
InChIInChI=1S/C17H21NO2/c1-13-3-5-14(6-4-13)17(18-11-12-19)15-7-9-16(20-2)10-8-15/h3-10,17-19H,11-12H2,1-2H3
InChIKeyPWKLUQRVBJGHCR-UHFFFAOYSA-N
MW271.36 g/mol
LogP2.67
Rot. Bonds6

About 2-[[(4-methoxyphenyl)-(4-methylphenyl)methyl]amino]ethanol

2-[[(4-methoxyphenyl)-(4-methylphenyl)methyl]amino]ethanol (PubChem CID 75482273) has the molecular formula C17H21NO2 and a molecular weight of 271.36 g/mol. Its IUPAC name is 2-[[(4-methoxyphenyl)-(4-methylphenyl)methyl]amino]ethanol.

Molecular Properties

Compound Name2-[[(4-methoxyphenyl)-(4-methylphenyl)methyl]amino]ethanol
PubChem CID75482273
Molecular FormulaC17H21NO2
Molecular Weight271.36 g/mol
Exact Mass271.16
IUPAC Name2-[[(4-methoxyphenyl)-(4-methylphenyl)methyl]amino]ethanol
SMILESCOc1ccc(C(NCCO)c2ccc(C)cc2)cc1
InChIInChI=1S/C17H21NO2/c1-13-3-5-14(6-4-13)17(18-11-12-19)15-7-9-16(20-2)10-8-15/h3-10,17-19H,11-12H2,1-2H3
InChIKeyPWKLUQRVBJGHCR-UHFFFAOYSA-N
XLogP2.67
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 52.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[(R)-(4-methoxyphenyl)-(4-methylphenyl)methyl]amino]-N,N-dimethylacetamide
CID 94814876
2-(2-hydroxyethylamino)-2-(4-methoxyphenyl)acetic acid
CID 82027139
6-(4-methoxyphenyl)-N-[(4-methylphenyl)-phenylmethyl]hexan-1-amine
CID 118579652
2-[2-[[(4-methylphenyl)-phenylmethyl]amino]ethoxy]ethanol
CID 110878023
1-(113C)methoxy-4-methylbenzene
CID 166176950
2-[[(1R)-1-(4-methylphenyl)propyl]amino]ethanol
CID 29083030
2-[1-(4-methylphenoxy)propan-2-ylamino]ethanol
CID 61166956
3-[1-(4-methoxyphenyl)ethylamino]propan-1-ol
CID 43206530
1-(4-methoxyphenyl)-2-[[(1R)-1-(4-methylphenyl)ethyl]amino]ethanol
CID 81347393
4-[[(4-methoxyphenyl)-phenylmethyl]amino]-3,3-dimethylbutan-1-ol
CID 110010974
N-[(4-methoxyphenyl)-(4-propan-2-ylphenyl)methyl]ethanamine
CID 43489198
2-[[(3-methylphenyl)-phenylmethyl]amino]ethanol
CID 144916597

Frequently Asked Questions

What is the IUPAC name of 2-[[(4-methoxyphenyl)-(4-methylphenyl)methyl]amino]ethanol?
The IUPAC name of 2-[[(4-methoxyphenyl)-(4-methylphenyl)methyl]amino]ethanol (CID 75482273) is 2-[[(4-methoxyphenyl)-(4-methylphenyl)methyl]amino]ethanol.
What is the SMILES notation for 2-[[(4-methoxyphenyl)-(4-methylphenyl)methyl]amino]ethanol?
The canonical SMILES for 2-[[(4-methoxyphenyl)-(4-methylphenyl)methyl]amino]ethanol is COc1ccc(C(NCCO)c2ccc(C)cc2)cc1.
What is the InChIKey of 2-[[(4-methoxyphenyl)-(4-methylphenyl)methyl]amino]ethanol?
The InChIKey is PWKLUQRVBJGHCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO2/c1-13-3-5-14(6-4-13)17(18-11-12-19)15-7-9-16(20-2)10-8-15/h3-10,17-19H,11-12H2,1-2H3.
What are the key properties of 2-[[(4-methoxyphenyl)-(4-methylphenyl)methyl]amino]ethanol?
2-[[(4-methoxyphenyl)-(4-methylphenyl)methyl]amino]ethanol has a molecular weight of 271.36 g/mol, XLogP of 2.67, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(4-methoxyphenyl)-(4-methylphenyl)methyl]amino]ethanol is sourced from PubChem (CID 75482273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).