2-[4-[(1-propylcyclopentyl)methyl]phenyl]ethanol

C17H26O — CID 70834822

IUPAC2-[4-[(1-propylcyclopentyl)methyl]phenyl]ethanol
SMILESCCCC1(Cc2ccc(CCO)cc2)CCCC1
InChIInChI=1S/C17H26O/c1-2-10-17(11-3-4-12-17)14-16-7-5-15(6-8-16)9-13-18/h5-8,18H,2-4,9-14H2,1H3
InChIKeyUYOAOTJEAXLXRH-UHFFFAOYSA-N
MW246.39 g/mol
LogP4.12
Rot. Bonds6

About 2-[4-[(1-propylcyclopentyl)methyl]phenyl]ethanol

2-[4-[(1-propylcyclopentyl)methyl]phenyl]ethanol (PubChem CID 70834822) has the molecular formula C17H26O and a molecular weight of 246.39 g/mol. Its IUPAC name is 2-[4-[(1-propylcyclopentyl)methyl]phenyl]ethanol.

Molecular Properties

Compound Name2-[4-[(1-propylcyclopentyl)methyl]phenyl]ethanol
PubChem CID70834822
Molecular FormulaC17H26O
Molecular Weight246.39 g/mol
Exact Mass246.20
IUPAC Name2-[4-[(1-propylcyclopentyl)methyl]phenyl]ethanol
SMILESCCCC1(Cc2ccc(CCO)cc2)CCCC1
InChIInChI=1S/C17H26O/c1-2-10-17(11-3-4-12-17)14-16-7-5-15(6-8-16)9-13-18/h5-8,18H,2-4,9-14H2,1H3
InChIKeyUYOAOTJEAXLXRH-UHFFFAOYSA-N
XLogP4.12
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.39
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-[4-[[1-(aminomethyl)cyclobutyl]methyl]phenyl]ethanol
CID 67025850
[1-[(4-propylphenyl)methyl]cyclopropyl]methanol
CID 116928838
1-ethynyl-4-[2-(1-propylcyclohexyl)ethyl]benzene
CID 57126613
2-[4-[(1-aminocyclopropyl)methyl]phenyl]ethanol
CID 117116056
N-[[1-[[4-(2-hydroxyethyl)phenyl]methyl]cyclopentyl]methyl]furan-2-sulfonamide
CID 18999495
1-[[1-(bromomethyl)cyclopentyl]methyl]-4-methylbenzene
CID 66048468
(1-octylcyclohexyl)methylbenzene
CID 90738886
[1-[(4-tert-butylphenyl)methyl]cyclopentyl]methanol
CID 66026781
N-methyl-2-[1-[2-(4-propylphenyl)ethyl]cyclohexyl]ethanamine
CID 65303003
[4-[[1-(aminomethyl)cyclopentyl]methyl]phenyl]methanol
CID 18999623
[1-[(4-propan-2-ylphenyl)methyl]cyclopentyl]methanol
CID 66026116
ethyl 1-[[4-(2-hydroxyethyl)phenyl]methyl]cyclopropane-1-carboxylate
CID 142527026

Frequently Asked Questions

What is the IUPAC name of 2-[4-[(1-propylcyclopentyl)methyl]phenyl]ethanol?
The IUPAC name of 2-[4-[(1-propylcyclopentyl)methyl]phenyl]ethanol (CID 70834822) is 2-[4-[(1-propylcyclopentyl)methyl]phenyl]ethanol.
What is the SMILES notation for 2-[4-[(1-propylcyclopentyl)methyl]phenyl]ethanol?
The canonical SMILES for 2-[4-[(1-propylcyclopentyl)methyl]phenyl]ethanol is CCCC1(Cc2ccc(CCO)cc2)CCCC1.
What is the InChIKey of 2-[4-[(1-propylcyclopentyl)methyl]phenyl]ethanol?
The InChIKey is UYOAOTJEAXLXRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26O/c1-2-10-17(11-3-4-12-17)14-16-7-5-15(6-8-16)9-13-18/h5-8,18H,2-4,9-14H2,1H3.
What are the key properties of 2-[4-[(1-propylcyclopentyl)methyl]phenyl]ethanol?
2-[4-[(1-propylcyclopentyl)methyl]phenyl]ethanol has a molecular weight of 246.39 g/mol, XLogP of 4.12, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(1-propylcyclopentyl)methyl]phenyl]ethanol is sourced from PubChem (CID 70834822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).