[3-[2-cyclopentylethyl(methyl)amino]phenyl]methanol

C15H23NO — CID 71908837

IUPAC[3-[2-cyclopentylethyl(methyl)amino]phenyl]methanol
SMILESCN(CCC1CCCC1)c1cccc(CO)c1
InChIInChI=1S/C15H23NO/c1-16(10-9-13-5-2-3-6-13)15-8-4-7-14(11-15)12-17/h4,7-8,11,13,17H,2-3,5-6,9-10,12H2,1H3
InChIKeyJDKGFLAVPGEEIL-UHFFFAOYSA-N
MW233.36 g/mol
LogP3.20
Rot. Bonds5

About [3-[2-cyclopentylethyl(methyl)amino]phenyl]methanol

[3-[2-cyclopentylethyl(methyl)amino]phenyl]methanol (PubChem CID 71908837) has the molecular formula C15H23NO and a molecular weight of 233.36 g/mol. Its IUPAC name is [3-[2-cyclopentylethyl(methyl)amino]phenyl]methanol.

Molecular Properties

Compound Name[3-[2-cyclopentylethyl(methyl)amino]phenyl]methanol
PubChem CID71908837
Molecular FormulaC15H23NO
Molecular Weight233.36 g/mol
Exact Mass233.18
IUPAC Name[3-[2-cyclopentylethyl(methyl)amino]phenyl]methanol
SMILESCN(CCC1CCCC1)c1cccc(CO)c1
InChIInChI=1S/C15H23NO/c1-16(10-9-13-5-2-3-6-13)15-8-4-7-14(11-15)12-17/h4,7-8,11,13,17H,2-3,5-6,9-10,12H2,1H3
InChIKeyJDKGFLAVPGEEIL-UHFFFAOYSA-N
XLogP3.20
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [3-[2-cyclopentylethyl(methyl)amino]phenyl]methanol?
The IUPAC name of [3-[2-cyclopentylethyl(methyl)amino]phenyl]methanol (CID 71908837) is [3-[2-cyclopentylethyl(methyl)amino]phenyl]methanol.
What is the SMILES notation for [3-[2-cyclopentylethyl(methyl)amino]phenyl]methanol?
The canonical SMILES for [3-[2-cyclopentylethyl(methyl)amino]phenyl]methanol is CN(CCC1CCCC1)c1cccc(CO)c1.
What is the InChIKey of [3-[2-cyclopentylethyl(methyl)amino]phenyl]methanol?
The InChIKey is JDKGFLAVPGEEIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-16(10-9-13-5-2-3-6-13)15-8-4-7-14(11-15)12-17/h4,7-8,11,13,17H,2-3,5-6,9-10,12H2,1H3.
What are the key properties of [3-[2-cyclopentylethyl(methyl)amino]phenyl]methanol?
[3-[2-cyclopentylethyl(methyl)amino]phenyl]methanol has a molecular weight of 233.36 g/mol, XLogP of 3.20, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[2-cyclopentylethyl(methyl)amino]phenyl]methanol is sourced from PubChem (CID 71908837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).