[2-(2-piperidin-1-ylethyl)-1-(propan-2-ylamino)cyclopentyl]methanol

C16H32N2O — CID 79571987

IUPAC[2-(2-piperidin-1-ylethyl)-1-(propan-2-ylamino)cyclopentyl]methanol
SMILESCC(C)NC1(CO)CCCC1CCN1CCCCC1
InChIInChI=1S/C16H32N2O/c1-14(2)17-16(13-19)9-6-7-15(16)8-12-18-10-4-3-5-11-18/h14-15,17,19H,3-13H2,1-2H3
InChIKeySAVMLNLEEGHKBR-UHFFFAOYSA-N
MW268.44 g/mol
LogP2.39
Rot. Bonds6

About [2-(2-piperidin-1-ylethyl)-1-(propan-2-ylamino)cyclopentyl]methanol

[2-(2-piperidin-1-ylethyl)-1-(propan-2-ylamino)cyclopentyl]methanol (PubChem CID 79571987) has the molecular formula C16H32N2O and a molecular weight of 268.44 g/mol. Its IUPAC name is [2-(2-piperidin-1-ylethyl)-1-(propan-2-ylamino)cyclopentyl]methanol.

Molecular Properties

Compound Name[2-(2-piperidin-1-ylethyl)-1-(propan-2-ylamino)cyclopentyl]methanol
PubChem CID79571987
Molecular FormulaC16H32N2O
Molecular Weight268.44 g/mol
Exact Mass268.25
IUPAC Name[2-(2-piperidin-1-ylethyl)-1-(propan-2-ylamino)cyclopentyl]methanol
SMILESCC(C)NC1(CO)CCCC1CCN1CCCCC1
InChIInChI=1S/C16H32N2O/c1-14(2)17-16(13-19)9-6-7-15(16)8-12-18-10-4-3-5-11-18/h14-15,17,19H,3-13H2,1-2H3
InChIKeySAVMLNLEEGHKBR-UHFFFAOYSA-N
XLogP2.39
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [2-(2-piperidin-1-ylethyl)-1-(propan-2-ylamino)cyclopentyl]methanol?
The IUPAC name of [2-(2-piperidin-1-ylethyl)-1-(propan-2-ylamino)cyclopentyl]methanol (CID 79571987) is [2-(2-piperidin-1-ylethyl)-1-(propan-2-ylamino)cyclopentyl]methanol.
What is the SMILES notation for [2-(2-piperidin-1-ylethyl)-1-(propan-2-ylamino)cyclopentyl]methanol?
The canonical SMILES for [2-(2-piperidin-1-ylethyl)-1-(propan-2-ylamino)cyclopentyl]methanol is CC(C)NC1(CO)CCCC1CCN1CCCCC1.
What is the InChIKey of [2-(2-piperidin-1-ylethyl)-1-(propan-2-ylamino)cyclopentyl]methanol?
The InChIKey is SAVMLNLEEGHKBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O/c1-14(2)17-16(13-19)9-6-7-15(16)8-12-18-10-4-3-5-11-18/h14-15,17,19H,3-13H2,1-2H3.
What are the key properties of [2-(2-piperidin-1-ylethyl)-1-(propan-2-ylamino)cyclopentyl]methanol?
[2-(2-piperidin-1-ylethyl)-1-(propan-2-ylamino)cyclopentyl]methanol has a molecular weight of 268.44 g/mol, XLogP of 2.39, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-piperidin-1-ylethyl)-1-(propan-2-ylamino)cyclopentyl]methanol is sourced from PubChem (CID 79571987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).