1-cyclopentyl-2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethanol

C17H32N2O — CID 104752834

IUPAC1-cyclopentyl-2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethanol
SMILESOC(CN1CCC(CN2CCCC2)CC1)C1CCCC1
InChIInChI=1S/C17H32N2O/c20-17(16-5-1-2-6-16)14-19-11-7-15(8-12-19)13-18-9-3-4-10-18/h15-17,20H,1-14H2
InChIKeyHDGRHXWNCFHWGQ-UHFFFAOYSA-N
MW280.46 g/mol
LogP2.35
Rot. Bonds5

About 1-cyclopentyl-2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethanol

1-cyclopentyl-2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethanol (PubChem CID 104752834) has the molecular formula C17H32N2O and a molecular weight of 280.46 g/mol. Its IUPAC name is 1-cyclopentyl-2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethanol.

Molecular Properties

Compound Name1-cyclopentyl-2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethanol
PubChem CID104752834
Molecular FormulaC17H32N2O
Molecular Weight280.46 g/mol
Exact Mass280.25
IUPAC Name1-cyclopentyl-2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethanol
SMILESOC(CN1CCC(CN2CCCC2)CC1)C1CCCC1
InChIInChI=1S/C17H32N2O/c20-17(16-5-1-2-6-16)14-19-11-7-15(8-12-19)13-18-9-3-4-10-18/h15-17,20H,1-14H2
InChIKeyHDGRHXWNCFHWGQ-UHFFFAOYSA-N
XLogP2.35
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.46
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclopentyl-2-[4-(cyclopropylmethyl)piperazin-1-yl]ethanol
CID 113449144
1-cyclobutyl-2-pyrrolidin-1-ylethanol
CID 117245548
1-cyclopentyl-2-(4-propylpiperidin-1-yl)ethanol
CID 104752787
1-(cyclopropylamino)-3-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propan-2-ol
CID 62996690
1-cyclopentyl-2-(1,4-oxazepan-4-yl)ethanol
CID 104752821
1-cyclohexyl-2-[4-(2-methylpropyl)piperazin-1-yl]ethanol
CID 104752803
2-(ethylamino)-3-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propan-1-ol
CID 64791676
2-methyl-3-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propanoic acid
CID 63009103
3-methyl-4-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]butan-2-amine
CID 113416111
2-methyl-3-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]propan-1-amine
CID 55141477
1-(1,1-dioxothian-4-yl)-2-piperidin-1-ylethanol
CID 117238604
2-(azepan-1-yl)-1-(1-ethylpyrrolidin-3-yl)ethanol
CID 117237190

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethanol?
The IUPAC name of 1-cyclopentyl-2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethanol (CID 104752834) is 1-cyclopentyl-2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethanol.
What is the SMILES notation for 1-cyclopentyl-2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethanol?
The canonical SMILES for 1-cyclopentyl-2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethanol is OC(CN1CCC(CN2CCCC2)CC1)C1CCCC1.
What is the InChIKey of 1-cyclopentyl-2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethanol?
The InChIKey is HDGRHXWNCFHWGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2O/c20-17(16-5-1-2-6-16)14-19-11-7-15(8-12-19)13-18-9-3-4-10-18/h15-17,20H,1-14H2.
What are the key properties of 1-cyclopentyl-2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethanol?
1-cyclopentyl-2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethanol has a molecular weight of 280.46 g/mol, XLogP of 2.35, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethanol is sourced from PubChem (CID 104752834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).