1-cyclopentyl-2-(2-cyclopentylpyrrolidin-1-yl)ethanol

C16H29NO — CID 104752736

IUPAC1-cyclopentyl-2-(2-cyclopentylpyrrolidin-1-yl)ethanol
SMILESOC(CN1CCCC1C1CCCC1)C1CCCC1
InChIInChI=1S/C16H29NO/c18-16(14-8-3-4-9-14)12-17-11-5-10-15(17)13-6-1-2-7-13/h13-16,18H,1-12H2
InChIKeyKDOOYYVRGWYFGB-UHFFFAOYSA-N
MW251.41 g/mol
LogP3.19
Rot. Bonds4

About 1-cyclopentyl-2-(2-cyclopentylpyrrolidin-1-yl)ethanol

1-cyclopentyl-2-(2-cyclopentylpyrrolidin-1-yl)ethanol (PubChem CID 104752736) has the molecular formula C16H29NO and a molecular weight of 251.41 g/mol. Its IUPAC name is 1-cyclopentyl-2-(2-cyclopentylpyrrolidin-1-yl)ethanol.

Molecular Properties

Compound Name1-cyclopentyl-2-(2-cyclopentylpyrrolidin-1-yl)ethanol
PubChem CID104752736
Molecular FormulaC16H29NO
Molecular Weight251.41 g/mol
Exact Mass251.22
IUPAC Name1-cyclopentyl-2-(2-cyclopentylpyrrolidin-1-yl)ethanol
SMILESOC(CN1CCCC1C1CCCC1)C1CCCC1
InChIInChI=1S/C16H29NO/c18-16(14-8-3-4-9-14)12-17-11-5-10-15(17)13-6-1-2-7-13/h13-16,18H,1-12H2
InChIKeyKDOOYYVRGWYFGB-UHFFFAOYSA-N
XLogP3.19
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.41
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-1-cyclohexylethanol
CID 102727879
(2R)-1-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)propan-2-ol
CID 103934975
(2R)-1-[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-3-propan-2-yloxypropan-2-ol
CID 129413626
2-[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-1-cyclopropylethanamine
CID 102725967
1-(2-cyclopentylpyrrolidin-1-yl)pentan-2-ol
CID 62044329
(2S)-1-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-3-aminopropan-2-ol
CID 130492481
1-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-3-chloropropan-2-ol
CID 112561733
1-(2,3,3a,4,5,6,7,7a-octahydroindol-1-yl)propan-2-ol
CID 82749699
1-cyclohexyl-2-(2-propan-2-ylpyrrolidin-1-yl)ethanol
CID 104752981
3-(2-cyclopentylpyrrolidin-1-yl)-2-(propan-2-ylamino)propan-1-ol
CID 64826732
1-(2,2-difluoroethyl)-2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridine
CID 130841053
1-(2-methylbutyl)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline
CID 176943757

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-2-(2-cyclopentylpyrrolidin-1-yl)ethanol?
The IUPAC name of 1-cyclopentyl-2-(2-cyclopentylpyrrolidin-1-yl)ethanol (CID 104752736) is 1-cyclopentyl-2-(2-cyclopentylpyrrolidin-1-yl)ethanol.
What is the SMILES notation for 1-cyclopentyl-2-(2-cyclopentylpyrrolidin-1-yl)ethanol?
The canonical SMILES for 1-cyclopentyl-2-(2-cyclopentylpyrrolidin-1-yl)ethanol is OC(CN1CCCC1C1CCCC1)C1CCCC1.
What is the InChIKey of 1-cyclopentyl-2-(2-cyclopentylpyrrolidin-1-yl)ethanol?
The InChIKey is KDOOYYVRGWYFGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29NO/c18-16(14-8-3-4-9-14)12-17-11-5-10-15(17)13-6-1-2-7-13/h13-16,18H,1-12H2.
What are the key properties of 1-cyclopentyl-2-(2-cyclopentylpyrrolidin-1-yl)ethanol?
1-cyclopentyl-2-(2-cyclopentylpyrrolidin-1-yl)ethanol has a molecular weight of 251.41 g/mol, XLogP of 3.19, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-2-(2-cyclopentylpyrrolidin-1-yl)ethanol is sourced from PubChem (CID 104752736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).