(2S)-1-(4-piperidin-1-ylpiperidin-1-yl)propan-2-ol

C13H26N2O — CID 103934988

IUPAC(2S)-1-(4-piperidin-1-ylpiperidin-1-yl)propan-2-ol
SMILESC[C@H](O)CN1CCC(N2CCCCC2)CC1
InChIInChI=1S/C13H26N2O/c1-12(16)11-14-9-5-13(6-10-14)15-7-3-2-4-8-15/h12-13,16H,2-11H2,1H3/t12-/m0/s1
InChIKeyBWVYUILMSCUBKT-LBPRGKRZSA-N
MW226.36 g/mol
LogP1.32
Rot. Bonds3

About (2S)-1-(4-piperidin-1-ylpiperidin-1-yl)propan-2-ol

(2S)-1-(4-piperidin-1-ylpiperidin-1-yl)propan-2-ol (PubChem CID 103934988) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is (2S)-1-(4-piperidin-1-ylpiperidin-1-yl)propan-2-ol.

Molecular Properties

Compound Name(2S)-1-(4-piperidin-1-ylpiperidin-1-yl)propan-2-ol
PubChem CID103934988
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name(2S)-1-(4-piperidin-1-ylpiperidin-1-yl)propan-2-ol
SMILESC[C@H](O)CN1CCC(N2CCCCC2)CC1
InChIInChI=1S/C13H26N2O/c1-12(16)11-14-9-5-13(6-10-14)15-7-3-2-4-8-15/h12-13,16H,2-11H2,1H3/t12-/m0/s1
InChIKeyBWVYUILMSCUBKT-LBPRGKRZSA-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

Analyze (2S)-1-(4-piperidin-1-ylpiperidin-1-yl)propan-2-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(azacyclododec-1-yl)propan-2-ol
CID 58868254
1-(4-piperidin-1-ylpiperidin-1-yl)-3-propan-2-yloxypropan-2-ol
CID 60966443
(2S)-1-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)propan-2-ol
CID 103935255
1-(2,2-dimethoxyethyl)-4-piperidin-1-ylpiperidine
CID 66223606
1-[(2-methylpropan-2-yl)oxy]-3-(4-pyrrolidin-1-ylpiperidin-1-yl)propan-2-ol
CID 110898534
3-amino-4-(4-piperidin-1-ylpiperidin-1-yl)butan-1-ol
CID 64898995
1-(3-morpholin-4-ylpyrrolidin-1-yl)propan-2-ol
CID 63171130
1-(3-piperidin-1-ylpyrrolidin-1-yl)butan-2-ol
CID 63170952
1-(4-aminopiperidin-1-yl)propan-2-ol
CID 60886845
1-[4,7-bis(2-hydroxypropyl)-1,4,7-triazonan-1-yl]propan-2-ol
CID 4961557
(2S)-1-[4,7-bis[(2S)-2-hydroxypropyl]-1,4,7-triazonan-1-yl]propan-2-ol
CID 10935575
4-(4-piperidin-1-ylpiperidin-1-yl)butan-2-amine
CID 61215952

Frequently Asked Questions

What is the IUPAC name of (2S)-1-(4-piperidin-1-ylpiperidin-1-yl)propan-2-ol?
The IUPAC name of (2S)-1-(4-piperidin-1-ylpiperidin-1-yl)propan-2-ol (CID 103934988) is (2S)-1-(4-piperidin-1-ylpiperidin-1-yl)propan-2-ol.
What is the SMILES notation for (2S)-1-(4-piperidin-1-ylpiperidin-1-yl)propan-2-ol?
The canonical SMILES for (2S)-1-(4-piperidin-1-ylpiperidin-1-yl)propan-2-ol is C[C@H](O)CN1CCC(N2CCCCC2)CC1.
What is the InChIKey of (2S)-1-(4-piperidin-1-ylpiperidin-1-yl)propan-2-ol?
The InChIKey is BWVYUILMSCUBKT-LBPRGKRZSA-N. The full InChI is InChI=1S/C13H26N2O/c1-12(16)11-14-9-5-13(6-10-14)15-7-3-2-4-8-15/h12-13,16H,2-11H2,1H3/t12-/m0/s1.
What are the key properties of (2S)-1-(4-piperidin-1-ylpiperidin-1-yl)propan-2-ol?
(2S)-1-(4-piperidin-1-ylpiperidin-1-yl)propan-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 (2S)-1-(4-piperidin-1-ylpiperidin-1-yl)propan-2-ol is sourced from PubChem (CID 103934988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).