2-[methyl-[[4-(2-methylpropyl)phenyl]methyl]amino]ethanol

C14H23NO — CID 110921350

IUPAC2-[methyl-[[4-(2-methylpropyl)phenyl]methyl]amino]ethanol
SMILESCC(C)Cc1ccc(CN(C)CCO)cc1
InChIInChI=1S/C14H23NO/c1-12(2)10-13-4-6-14(7-5-13)11-15(3)8-9-16/h4-7,12,16H,8-11H2,1-3H3
InChIKeyYWZYYEGYCPBWCX-UHFFFAOYSA-N
MW221.34 g/mol
LogP2.31
Rot. Bonds6

About 2-[methyl-[[4-(2-methylpropyl)phenyl]methyl]amino]ethanol

2-[methyl-[[4-(2-methylpropyl)phenyl]methyl]amino]ethanol (PubChem CID 110921350) has the molecular formula C14H23NO and a molecular weight of 221.34 g/mol. Its IUPAC name is 2-[methyl-[[4-(2-methylpropyl)phenyl]methyl]amino]ethanol.

Molecular Properties

Compound Name2-[methyl-[[4-(2-methylpropyl)phenyl]methyl]amino]ethanol
PubChem CID110921350
Molecular FormulaC14H23NO
Molecular Weight221.34 g/mol
Exact Mass221.18
IUPAC Name2-[methyl-[[4-(2-methylpropyl)phenyl]methyl]amino]ethanol
SMILESCC(C)Cc1ccc(CN(C)CCO)cc1
InChIInChI=1S/C14H23NO/c1-12(2)10-13-4-6-14(7-5-13)11-15(3)8-9-16/h4-7,12,16H,8-11H2,1-3H3
InChIKeyYWZYYEGYCPBWCX-UHFFFAOYSA-N
XLogP2.31
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.34
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-[methyl-[[4-(2-methylpropyl)phenyl]methyl]amino]ethanol 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

1-N-methyl-1-N-[[4-(2-methylpropyl)phenyl]methyl]butane-1,3-diamine
CID 115199389
2-[2-hydroxyethyl(methyl)amino]-1-[4-(2-methylpropyl)phenyl]ethanol
CID 82217026
N-(bromomethyl)-N-methyl-1-[4-(2-methylpropyl)phenyl]methanamine
CID 115262015
2-[(4-aminophenyl)methyl-methylamino]ethanol
CID 23507043
2-[methyl-[(4-phenylphenyl)methyl]amino]ethanol
CID 60683589
2-[[4-(difluoromethoxy)phenyl]methyl-methylamino]ethanol
CID 110901993
3-methyl-2-[methyl-[[4-(2-methylpropyl)phenyl]methyl]amino]butan-1-ol
CID 115137587
2-[methyl-[[4-(2-methylpropyl)phenyl]methyl]amino]-2-oxoacetic acid
CID 115141371
N-methyl-N-[[4-(2-methylpropyl)phenyl]methyl]-2-oxopropanamide
CID 115175745
[4-[(dimethylamino)methyl]phenyl]-[4-(2-methylpropyl)phenyl]methanone
CID 58820967
1-N,2-N,2-trimethyl-1-N-[[4-(2-methylpropyl)phenyl]methyl]propane-1,2-diamine
CID 115222338
[N-methyl-4-(2-methylpropyl)anilino]methanol
CID 115228791

Frequently Asked Questions

What is the IUPAC name of 2-[methyl-[[4-(2-methylpropyl)phenyl]methyl]amino]ethanol?
The IUPAC name of 2-[methyl-[[4-(2-methylpropyl)phenyl]methyl]amino]ethanol (CID 110921350) is 2-[methyl-[[4-(2-methylpropyl)phenyl]methyl]amino]ethanol.
What is the SMILES notation for 2-[methyl-[[4-(2-methylpropyl)phenyl]methyl]amino]ethanol?
The canonical SMILES for 2-[methyl-[[4-(2-methylpropyl)phenyl]methyl]amino]ethanol is CC(C)Cc1ccc(CN(C)CCO)cc1.
What is the InChIKey of 2-[methyl-[[4-(2-methylpropyl)phenyl]methyl]amino]ethanol?
The InChIKey is YWZYYEGYCPBWCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO/c1-12(2)10-13-4-6-14(7-5-13)11-15(3)8-9-16/h4-7,12,16H,8-11H2,1-3H3.
What are the key properties of 2-[methyl-[[4-(2-methylpropyl)phenyl]methyl]amino]ethanol?
2-[methyl-[[4-(2-methylpropyl)phenyl]methyl]amino]ethanol has a molecular weight of 221.34 g/mol, XLogP of 2.31, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl-[[4-(2-methylpropyl)phenyl]methyl]amino]ethanol is sourced from PubChem (CID 110921350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).