[3-[1-(4-methylphenyl)propylamino]phenyl]methanol

C17H21NO — CID 43715171

IUPAC[3-[1-(4-methylphenyl)propylamino]phenyl]methanol
SMILESCCC(Nc1cccc(CO)c1)c1ccc(C)cc1
InChIInChI=1S/C17H21NO/c1-3-17(15-9-7-13(2)8-10-15)18-16-6-4-5-14(11-16)12-19/h4-11,17-19H,3,12H2,1-2H3
InChIKeyAGRKYEYCCHRABO-UHFFFAOYSA-N
MW255.36 g/mol
LogP4.05
Rot. Bonds5

About [3-[1-(4-methylphenyl)propylamino]phenyl]methanol

[3-[1-(4-methylphenyl)propylamino]phenyl]methanol (PubChem CID 43715171) has the molecular formula C17H21NO and a molecular weight of 255.36 g/mol. Its IUPAC name is [3-[1-(4-methylphenyl)propylamino]phenyl]methanol.

Molecular Properties

Compound Name[3-[1-(4-methylphenyl)propylamino]phenyl]methanol
PubChem CID43715171
Molecular FormulaC17H21NO
Molecular Weight255.36 g/mol
Exact Mass255.16
IUPAC Name[3-[1-(4-methylphenyl)propylamino]phenyl]methanol
SMILESCCC(Nc1cccc(CO)c1)c1ccc(C)cc1
InChIInChI=1S/C17H21NO/c1-3-17(15-9-7-13(2)8-10-15)18-16-6-4-5-14(11-16)12-19/h4-11,17-19H,3,12H2,1-2H3
InChIKeyAGRKYEYCCHRABO-UHFFFAOYSA-N
XLogP4.05
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 54.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze [3-[1-(4-methylphenyl)propylamino]phenyl]methanol 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

3-(methoxymethyl)-N-[1-(4-methylphenyl)propyl]aniline
CID 43672248
3-[1-(4-methylphenyl)propylamino]phenol
CID 43207013
3-ethynyl-N-[1-(4-methylphenyl)propyl]aniline
CID 43109716
4-[1-[3-(methoxymethyl)anilino]propyl]phenol
CID 43672141
[3-(1-phenylbutan-2-ylamino)phenyl]methanol
CID 79007308
3-(methoxymethyl)-N-(1-phenylpropyl)aniline
CID 43672251
N-[1-(4-fluorophenyl)propyl]-3-(methoxymethyl)aniline
CID 43672253
2-[3-[1-(4-methylphenyl)propylamino]phenoxy]acetonitrile
CID 43721247
[3-[1-(5-fluoro-2-pyridinyl)propylamino]phenyl]methanol
CID 112582984
[3-(2-ethylbutylamino)phenyl]methanol
CID 43715042
1-(4-methylphenyl)-N-[(3-methylphenyl)methyl]propan-1-amine
CID 43080790
N'-[3-(hydroxymethyl)phenyl]-N-(4-methylphenyl)oxamide
CID 60659461

Frequently Asked Questions

What is the IUPAC name of [3-[1-(4-methylphenyl)propylamino]phenyl]methanol?
The IUPAC name of [3-[1-(4-methylphenyl)propylamino]phenyl]methanol (CID 43715171) is [3-[1-(4-methylphenyl)propylamino]phenyl]methanol.
What is the SMILES notation for [3-[1-(4-methylphenyl)propylamino]phenyl]methanol?
The canonical SMILES for [3-[1-(4-methylphenyl)propylamino]phenyl]methanol is CCC(Nc1cccc(CO)c1)c1ccc(C)cc1.
What is the InChIKey of [3-[1-(4-methylphenyl)propylamino]phenyl]methanol?
The InChIKey is AGRKYEYCCHRABO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO/c1-3-17(15-9-7-13(2)8-10-15)18-16-6-4-5-14(11-16)12-19/h4-11,17-19H,3,12H2,1-2H3.
What are the key properties of [3-[1-(4-methylphenyl)propylamino]phenyl]methanol?
[3-[1-(4-methylphenyl)propylamino]phenyl]methanol has a molecular weight of 255.36 g/mol, XLogP of 4.05, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[1-(4-methylphenyl)propylamino]phenyl]methanol is sourced from PubChem (CID 43715171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).