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

C11H22N2O — CID 117270876

IUPAC[4-(piperidin-1-ylmethyl)pyrrolidin-2-yl]methanol
SMILESOCC1CC(CN2CCCCC2)CN1
InChIInChI=1S/C11H22N2O/c14-9-11-6-10(7-12-11)8-13-4-2-1-3-5-13/h10-12,14H,1-9H2
InChIKeyJQHOEPGDKDQEQS-UHFFFAOYSA-N
MW198.31 g/mol
LogP0.44
Rot. Bonds3

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

[4-(piperidin-1-ylmethyl)pyrrolidin-2-yl]methanol (PubChem CID 117270876) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is [4-(piperidin-1-ylmethyl)pyrrolidin-2-yl]methanol.

Molecular Properties

Compound Name[4-(piperidin-1-ylmethyl)pyrrolidin-2-yl]methanol
PubChem CID117270876
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name[4-(piperidin-1-ylmethyl)pyrrolidin-2-yl]methanol
SMILESOCC1CC(CN2CCCCC2)CN1
InChIInChI=1S/C11H22N2O/c14-9-11-6-10(7-12-11)8-13-4-2-1-3-5-13/h10-12,14H,1-9H2
InChIKeyJQHOEPGDKDQEQS-UHFFFAOYSA-N
XLogP0.44
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 50.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1,4'-Bipiperidin-3-ylmethanol
CID 23092060
8-Methyl-1,8-diazaspiro[4.5]decan-3-ol
CID 115013789
2-(1,2,5-Trimethyl-piperidin-4-ylamino)-butan-1-ol
CID 6486630
(4,4-Difluoro-1-(piperidin-4-yl)pyrrolidin-2-yl)methanol
CID 121204083
[(2R)-4,4-difluoro-1-piperidin-4-ylpyrrolidin-2-yl]methanol
CID 126557145
[(2R,4R)-4-fluoro-1-piperidin-4-ylpyrrolidin-2-yl]methanol
CID 146279216
(4-Fluoro-1-piperidin-4-ylpyrrolidin-2-yl)methanol
CID 146288084
[(2R)-4-fluoro-1-piperidin-4-ylpyrrolidin-2-yl]methanol
CID 153377333
1-[(Piperidin-3-yl)methyl]pyrrolidin-3-ol
CID 56831533
[4-Fluoro-1-(piperidin-3-ylmethyl)pyrrolidin-2-yl]methanol
CID 120854640
[4-Fluoro-1-(piperidin-4-ylmethyl)pyrrolidin-2-yl]methanol
CID 120854642
[(2S)-4,4-difluoro-1-piperidin-4-ylpyrrolidin-2-yl]methanol
CID 129501795

Frequently Asked Questions

What is the IUPAC name of [4-(piperidin-1-ylmethyl)pyrrolidin-2-yl]methanol?
The IUPAC name of [4-(piperidin-1-ylmethyl)pyrrolidin-2-yl]methanol (CID 117270876) is [4-(piperidin-1-ylmethyl)pyrrolidin-2-yl]methanol.
What is the SMILES notation for [4-(piperidin-1-ylmethyl)pyrrolidin-2-yl]methanol?
The canonical SMILES for [4-(piperidin-1-ylmethyl)pyrrolidin-2-yl]methanol is OCC1CC(CN2CCCCC2)CN1.
What is the InChIKey of [4-(piperidin-1-ylmethyl)pyrrolidin-2-yl]methanol?
The InChIKey is JQHOEPGDKDQEQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c14-9-11-6-10(7-12-11)8-13-4-2-1-3-5-13/h10-12,14H,1-9H2.
What are the key properties of [4-(piperidin-1-ylmethyl)pyrrolidin-2-yl]methanol?
[4-(piperidin-1-ylmethyl)pyrrolidin-2-yl]methanol has a molecular weight of 198.31 g/mol, XLogP of 0.44, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(piperidin-1-ylmethyl)pyrrolidin-2-yl]methanol is sourced from PubChem (CID 117270876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).