[3-[(2,2-dimethylcyclopentyl)amino]phenyl]methanol

C14H21NO — CID 79859836

IUPAC[3-[(2,2-dimethylcyclopentyl)amino]phenyl]methanol
SMILESCC1(C)CCCC1Nc1cccc(CO)c1
InChIInChI=1S/C14H21NO/c1-14(2)8-4-7-13(14)15-12-6-3-5-11(9-12)10-16/h3,5-6,9,13,15-16H,4,7-8,10H2,1-2H3
InChIKeyTWLJZNILQSGOHV-UHFFFAOYSA-N
MW219.33 g/mol
LogP3.17
Rot. Bonds3

About [3-[(2,2-dimethylcyclopentyl)amino]phenyl]methanol

[3-[(2,2-dimethylcyclopentyl)amino]phenyl]methanol (PubChem CID 79859836) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is [3-[(2,2-dimethylcyclopentyl)amino]phenyl]methanol.

Molecular Properties

Compound Name[3-[(2,2-dimethylcyclopentyl)amino]phenyl]methanol
PubChem CID79859836
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name[3-[(2,2-dimethylcyclopentyl)amino]phenyl]methanol
SMILESCC1(C)CCCC1Nc1cccc(CO)c1
InChIInChI=1S/C14H21NO/c1-14(2)8-4-7-13(14)15-12-6-3-5-11(9-12)10-16/h3,5-6,9,13,15-16H,4,7-8,10H2,1-2H3
InChIKeyTWLJZNILQSGOHV-UHFFFAOYSA-N
XLogP3.17
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 53.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-chloro-N-(2,2-dimethylcyclopentyl)aniline
CID 79865179
N-[3-[(2,2-dimethylcyclopentyl)amino]phenyl]acetamide
CID 79864740
N-(2,2-dimethylcyclopentyl)-3-methoxyaniline
CID 79864652
3-[(2,2-dimethylcyclopentyl)amino]-N-propylbenzamide
CID 79864777
2-[3-[(2,2-dimethylcyclopentyl)amino]phenoxy]acetonitrile
CID 79860485
[5-[(2,2-dimethylcyclopentyl)amino]-2-ethoxyphenyl]methanol
CID 79860686
N-(2,2-dimethylcyclopentyl)-3-(2H-tetrazol-5-yl)aniline
CID 79859855
[4-[[(2,2-dimethylcyclopentyl)amino]methyl]phenyl]methanol
CID 113365810
4-N-(2,2-dimethylcyclopentyl)-2-methylbenzene-1,4-diamine
CID 79862138
[3-[[2,2-dimethyl-3-(2-methylpropoxy)cyclobutyl]amino]phenyl]methanol
CID 64850786
3-[(2,2-dimethylcyclohexyl)amino]-N-methylbenzenesulfonamide
CID 79828479
N-(2,2-dimethylcyclobutyl)-3-fluoroaniline
CID 130532973

Frequently Asked Questions

What is the IUPAC name of [3-[(2,2-dimethylcyclopentyl)amino]phenyl]methanol?
The IUPAC name of [3-[(2,2-dimethylcyclopentyl)amino]phenyl]methanol (CID 79859836) is [3-[(2,2-dimethylcyclopentyl)amino]phenyl]methanol.
What is the SMILES notation for [3-[(2,2-dimethylcyclopentyl)amino]phenyl]methanol?
The canonical SMILES for [3-[(2,2-dimethylcyclopentyl)amino]phenyl]methanol is CC1(C)CCCC1Nc1cccc(CO)c1.
What is the InChIKey of [3-[(2,2-dimethylcyclopentyl)amino]phenyl]methanol?
The InChIKey is TWLJZNILQSGOHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-14(2)8-4-7-13(14)15-12-6-3-5-11(9-12)10-16/h3,5-6,9,13,15-16H,4,7-8,10H2,1-2H3.
What are the key properties of [3-[(2,2-dimethylcyclopentyl)amino]phenyl]methanol?
[3-[(2,2-dimethylcyclopentyl)amino]phenyl]methanol has a molecular weight of 219.33 g/mol, XLogP of 3.17, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[(2,2-dimethylcyclopentyl)amino]phenyl]methanol is sourced from PubChem (CID 79859836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).