1-cyclopentyl-3-[3-(1-hydroxyethyl)pyrrolidin-1-yl]propan-2-ol

C14H27NO2 — CID 103160169

IUPAC1-cyclopentyl-3-[3-(1-hydroxyethyl)pyrrolidin-1-yl]propan-2-ol
SMILESCC(O)C1CCN(CC(O)CC2CCCC2)C1
InChIInChI=1S/C14H27NO2/c1-11(16)13-6-7-15(9-13)10-14(17)8-12-4-2-3-5-12/h11-14,16-17H,2-10H2,1H3
InChIKeyIGAWFLKNPBBZRW-UHFFFAOYSA-N
MW241.37 g/mol
LogP1.63
Rot. Bonds5

About 1-cyclopentyl-3-[3-(1-hydroxyethyl)pyrrolidin-1-yl]propan-2-ol

1-cyclopentyl-3-[3-(1-hydroxyethyl)pyrrolidin-1-yl]propan-2-ol (PubChem CID 103160169) has the molecular formula C14H27NO2 and a molecular weight of 241.37 g/mol. Its IUPAC name is 1-cyclopentyl-3-[3-(1-hydroxyethyl)pyrrolidin-1-yl]propan-2-ol.

Molecular Properties

Compound Name1-cyclopentyl-3-[3-(1-hydroxyethyl)pyrrolidin-1-yl]propan-2-ol
PubChem CID103160169
Molecular FormulaC14H27NO2
Molecular Weight241.37 g/mol
Exact Mass241.20
IUPAC Name1-cyclopentyl-3-[3-(1-hydroxyethyl)pyrrolidin-1-yl]propan-2-ol
SMILESCC(O)C1CCN(CC(O)CC2CCCC2)C1
InChIInChI=1S/C14H27NO2/c1-11(16)13-6-7-15(9-13)10-14(17)8-12-4-2-3-5-12/h11-14,16-17H,2-10H2,1H3
InChIKeyIGAWFLKNPBBZRW-UHFFFAOYSA-N
XLogP1.63
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.37
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-3-[3-(1-hydroxyethyl)pyrrolidin-1-yl]propan-2-ol?
The IUPAC name of 1-cyclopentyl-3-[3-(1-hydroxyethyl)pyrrolidin-1-yl]propan-2-ol (CID 103160169) is 1-cyclopentyl-3-[3-(1-hydroxyethyl)pyrrolidin-1-yl]propan-2-ol.
What is the SMILES notation for 1-cyclopentyl-3-[3-(1-hydroxyethyl)pyrrolidin-1-yl]propan-2-ol?
The canonical SMILES for 1-cyclopentyl-3-[3-(1-hydroxyethyl)pyrrolidin-1-yl]propan-2-ol is CC(O)C1CCN(CC(O)CC2CCCC2)C1.
What is the InChIKey of 1-cyclopentyl-3-[3-(1-hydroxyethyl)pyrrolidin-1-yl]propan-2-ol?
The InChIKey is IGAWFLKNPBBZRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO2/c1-11(16)13-6-7-15(9-13)10-14(17)8-12-4-2-3-5-12/h11-14,16-17H,2-10H2,1H3.
What are the key properties of 1-cyclopentyl-3-[3-(1-hydroxyethyl)pyrrolidin-1-yl]propan-2-ol?
1-cyclopentyl-3-[3-(1-hydroxyethyl)pyrrolidin-1-yl]propan-2-ol has a molecular weight of 241.37 g/mol, XLogP of 1.63, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-3-[3-(1-hydroxyethyl)pyrrolidin-1-yl]propan-2-ol is sourced from PubChem (CID 103160169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).