1-cyclobutyl-2-pyrrolidin-1-ylethanol

C10H19NO — CID 117245548

IUPAC1-cyclobutyl-2-pyrrolidin-1-ylethanol
SMILESOC(CN1CCCC1)C1CCC1
InChIInChI=1S/C10H19NO/c12-10(9-4-3-5-9)8-11-6-1-2-7-11/h9-10,12H,1-8H2
InChIKeyPWPFCLRSUIAGAE-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.24
Rot. Bonds3

About 1-cyclobutyl-2-pyrrolidin-1-ylethanol

1-cyclobutyl-2-pyrrolidin-1-ylethanol (PubChem CID 117245548) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 1-cyclobutyl-2-pyrrolidin-1-ylethanol.

Molecular Properties

Compound Name1-cyclobutyl-2-pyrrolidin-1-ylethanol
PubChem CID117245548
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name1-cyclobutyl-2-pyrrolidin-1-ylethanol
SMILESOC(CN1CCCC1)C1CCC1
InChIInChI=1S/C10H19NO/c12-10(9-4-3-5-9)8-11-6-1-2-7-11/h9-10,12H,1-8H2
InChIKeyPWPFCLRSUIAGAE-UHFFFAOYSA-N
XLogP1.24
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclopentyl-2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethanol
CID 104752834
1-(1,1-dioxothian-4-yl)-2-piperidin-1-ylethanol
CID 117238604
1-cyclopentyl-2-(1,4-oxazepan-4-yl)ethanol
CID 104752821
1-cyclopentyl-2-[4-(cyclopropylmethyl)piperazin-1-yl]ethanol
CID 113449144
1-cyclohexyl-2-[4-(2-methylpropyl)piperazin-1-yl]ethanol
CID 104752803
2-(azepan-1-yl)-1-(1-ethylpyrrolidin-3-yl)ethanol
CID 117237190
1-(1-ethylpyrrolidin-3-yl)-2-piperidin-1-ylethanol
CID 117237179
1-cyclopentyl-2-(4-propylpiperidin-1-yl)ethanol
CID 104752787
1-(azepan-1-yl)-2-[4-[(2S)-2-cyclopropyl-2-hydroxyethyl]piperazin-1-yl]ethanone
CID 97038948
cyclohexyl-[4-(2-cyclopropyl-2-hydroxyethyl)piperazin-1-yl]methanone
CID 71783040
1-cyclopentyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethanol
CID 104752985
1-cyclopropyl-2-(4-propan-2-ylpiperazin-1-yl)ethanol
CID 63908037

Frequently Asked Questions

What is the IUPAC name of 1-cyclobutyl-2-pyrrolidin-1-ylethanol?
The IUPAC name of 1-cyclobutyl-2-pyrrolidin-1-ylethanol (CID 117245548) is 1-cyclobutyl-2-pyrrolidin-1-ylethanol.
What is the SMILES notation for 1-cyclobutyl-2-pyrrolidin-1-ylethanol?
The canonical SMILES for 1-cyclobutyl-2-pyrrolidin-1-ylethanol is OC(CN1CCCC1)C1CCC1.
What is the InChIKey of 1-cyclobutyl-2-pyrrolidin-1-ylethanol?
The InChIKey is PWPFCLRSUIAGAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c12-10(9-4-3-5-9)8-11-6-1-2-7-11/h9-10,12H,1-8H2.
What are the key properties of 1-cyclobutyl-2-pyrrolidin-1-ylethanol?
1-cyclobutyl-2-pyrrolidin-1-ylethanol has a molecular weight of 169.27 g/mol, XLogP of 1.24, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutyl-2-pyrrolidin-1-ylethanol is sourced from PubChem (CID 117245548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).