1-[(3-piperidin-1-ylpyrrolidin-1-yl)methyl]cyclohexan-1-ol

C16H30N2O — CID 63723420

IUPAC1-[(3-piperidin-1-ylpyrrolidin-1-yl)methyl]cyclohexan-1-ol
SMILESOC1(CN2CCC(N3CCCCC3)C2)CCCCC1
InChIInChI=1S/C16H30N2O/c19-16(8-3-1-4-9-16)14-17-12-7-15(13-17)18-10-5-2-6-11-18/h15,19H,1-14H2
InChIKeySUNOSIHHHZOXPV-UHFFFAOYSA-N
MW266.43 g/mol
LogP2.24
Rot. Bonds3

About 1-[(3-piperidin-1-ylpyrrolidin-1-yl)methyl]cyclohexan-1-ol

1-[(3-piperidin-1-ylpyrrolidin-1-yl)methyl]cyclohexan-1-ol (PubChem CID 63723420) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is 1-[(3-piperidin-1-ylpyrrolidin-1-yl)methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name1-[(3-piperidin-1-ylpyrrolidin-1-yl)methyl]cyclohexan-1-ol
PubChem CID63723420
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC Name1-[(3-piperidin-1-ylpyrrolidin-1-yl)methyl]cyclohexan-1-ol
SMILESOC1(CN2CCC(N3CCCCC3)C2)CCCCC1
InChIInChI=1S/C16H30N2O/c19-16(8-3-1-4-9-16)14-17-12-7-15(13-17)18-10-5-2-6-11-18/h15,19H,1-14H2
InChIKeySUNOSIHHHZOXPV-UHFFFAOYSA-N
XLogP2.24
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]cyclopentan-1-ol
CID 65212460
1-[(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)methyl]cyclohexan-1-ol
CID 115277735
1-[(4-cyclopropylpiperazin-1-yl)methyl]cyclohexan-1-ol
CID 63631721
1-[[3-(aminomethyl)pyrrolidin-1-yl]methyl]cyclohexan-1-ol
CID 65213325
[1-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]cyclopentyl]methanamine
CID 63168694
[1-[(3-piperidin-1-ylpyrrolidin-1-yl)methyl]cyclopropyl]methanamine
CID 115453856
1-[(1-hydroxycyclohexyl)methyl]piperidine-3-carboxylic acid
CID 65213320
1-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-ylmethyl)cyclohexan-1-amine
CID 79943257
2-[1-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]cyclopropyl]ethanimidamide
CID 65493773
1-[(1-hydroxycyclopentyl)methyl]piperidin-4-ol
CID 65213146
1-[(4-fluoropiperidin-1-yl)methyl]cyclopentan-1-ol
CID 126846312
(6R)-1-[(1-hydroxycyclohexyl)methyl]-4-(oxan-4-yl)-1,4-diazepane-6-carboxamide
CID 124993790

Frequently Asked Questions

What is the IUPAC name of 1-[(3-piperidin-1-ylpyrrolidin-1-yl)methyl]cyclohexan-1-ol?
The IUPAC name of 1-[(3-piperidin-1-ylpyrrolidin-1-yl)methyl]cyclohexan-1-ol (CID 63723420) is 1-[(3-piperidin-1-ylpyrrolidin-1-yl)methyl]cyclohexan-1-ol.
What is the SMILES notation for 1-[(3-piperidin-1-ylpyrrolidin-1-yl)methyl]cyclohexan-1-ol?
The canonical SMILES for 1-[(3-piperidin-1-ylpyrrolidin-1-yl)methyl]cyclohexan-1-ol is OC1(CN2CCC(N3CCCCC3)C2)CCCCC1.
What is the InChIKey of 1-[(3-piperidin-1-ylpyrrolidin-1-yl)methyl]cyclohexan-1-ol?
The InChIKey is SUNOSIHHHZOXPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O/c19-16(8-3-1-4-9-16)14-17-12-7-15(13-17)18-10-5-2-6-11-18/h15,19H,1-14H2.
What are the key properties of 1-[(3-piperidin-1-ylpyrrolidin-1-yl)methyl]cyclohexan-1-ol?
1-[(3-piperidin-1-ylpyrrolidin-1-yl)methyl]cyclohexan-1-ol has a molecular weight of 266.43 g/mol, XLogP of 2.24, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3-piperidin-1-ylpyrrolidin-1-yl)methyl]cyclohexan-1-ol is sourced from PubChem (CID 63723420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).