3-(3-piperidin-1-ylpyrrolidin-1-yl)butan-2-ol

C13H26N2O — CID 63171314

IUPAC3-(3-piperidin-1-ylpyrrolidin-1-yl)butan-2-ol
SMILESCC(O)C(C)N1CCC(N2CCCCC2)C1
InChIInChI=1S/C13H26N2O/c1-11(12(2)16)15-9-6-13(10-15)14-7-4-3-5-8-14/h11-13,16H,3-10H2,1-2H3
InChIKeyUDYWFXWTLDYQSR-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.32
Rot. Bonds3

About 3-(3-piperidin-1-ylpyrrolidin-1-yl)butan-2-ol

3-(3-piperidin-1-ylpyrrolidin-1-yl)butan-2-ol (PubChem CID 63171314) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is 3-(3-piperidin-1-ylpyrrolidin-1-yl)butan-2-ol.

Molecular Properties

Compound Name3-(3-piperidin-1-ylpyrrolidin-1-yl)butan-2-ol
PubChem CID63171314
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name3-(3-piperidin-1-ylpyrrolidin-1-yl)butan-2-ol
SMILESCC(O)C(C)N1CCC(N2CCCCC2)C1
InChIInChI=1S/C13H26N2O/c1-11(12(2)16)15-9-6-13(10-15)14-7-4-3-5-8-14/h11-13,16H,3-10H2,1-2H3
InChIKeyUDYWFXWTLDYQSR-UHFFFAOYSA-N
XLogP1.32
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1-propan-2-ylpyrrolidin-3-yl)piperidine
CID 58850224
(3S)-1-propan-2-yl-3-pyrrolidin-1-ylpyrrolidine
CID 130210207
1-[(1S)-1-iodoethyl]-3-pyrrolidin-1-ylpyrrolidine
CID 130220331
N-methyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)pentan-3-amine
CID 63169567
methyl 2-methyl-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)butanoate
CID 79413832
4-(3-piperidin-1-ylpyrrolidin-1-yl)pentan-2-amine
CID 64707229
2-methyl-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)butanehydrazide
CID 79408685
3-amino-4-methyl-2-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pentan-1-ol
CID 114357229
(2R,3R)-3-piperidin-1-ylbutan-2-ol
CID 51980607
N'-hydroxy-2-(3-pyrrolidin-1-ylpyrrolidin-1-yl)propanimidamide
CID 76986945
3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)butanoic acid
CID 63170702
2-(3-piperidin-1-ylpyrrolidin-1-yl)butanoic acid
CID 63170614

Frequently Asked Questions

What is the IUPAC name of 3-(3-piperidin-1-ylpyrrolidin-1-yl)butan-2-ol?
The IUPAC name of 3-(3-piperidin-1-ylpyrrolidin-1-yl)butan-2-ol (CID 63171314) is 3-(3-piperidin-1-ylpyrrolidin-1-yl)butan-2-ol.
What is the SMILES notation for 3-(3-piperidin-1-ylpyrrolidin-1-yl)butan-2-ol?
The canonical SMILES for 3-(3-piperidin-1-ylpyrrolidin-1-yl)butan-2-ol is CC(O)C(C)N1CCC(N2CCCCC2)C1.
What is the InChIKey of 3-(3-piperidin-1-ylpyrrolidin-1-yl)butan-2-ol?
The InChIKey is UDYWFXWTLDYQSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-11(12(2)16)15-9-6-13(10-15)14-7-4-3-5-8-14/h11-13,16H,3-10H2,1-2H3.
What are the key properties of 3-(3-piperidin-1-ylpyrrolidin-1-yl)butan-2-ol?
3-(3-piperidin-1-ylpyrrolidin-1-yl)butan-2-ol has a molecular weight of 226.36 g/mol, XLogP of 1.32, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-piperidin-1-ylpyrrolidin-1-yl)butan-2-ol is sourced from PubChem (CID 63171314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).