(1S)-1-[1-[1-(2-methylpropyl)piperidin-4-yl]piperidin-4-yl]ethanol

C16H32N2O — CID 95111576

IUPAC(1S)-1-[1-[1-(2-methylpropyl)piperidin-4-yl]piperidin-4-yl]ethanol
SMILESCC(C)CN1CCC(N2CCC([C@H](C)O)CC2)CC1
InChIInChI=1S/C16H32N2O/c1-13(2)12-17-8-6-16(7-9-17)18-10-4-15(5-11-18)14(3)19/h13-16,19H,4-12H2,1-3H3/t14-/m0/s1
InChIKeyAROXWTKGNCJMAN-AWEZNQCLSA-N
MW268.44 g/mol
LogP2.20
Rot. Bonds4

About (1S)-1-[1-[1-(2-methylpropyl)piperidin-4-yl]piperidin-4-yl]ethanol

(1S)-1-[1-[1-(2-methylpropyl)piperidin-4-yl]piperidin-4-yl]ethanol (PubChem CID 95111576) has the molecular formula C16H32N2O and a molecular weight of 268.44 g/mol. Its IUPAC name is (1S)-1-[1-[1-(2-methylpropyl)piperidin-4-yl]piperidin-4-yl]ethanol.

Molecular Properties

Compound Name(1S)-1-[1-[1-(2-methylpropyl)piperidin-4-yl]piperidin-4-yl]ethanol
PubChem CID95111576
Molecular FormulaC16H32N2O
Molecular Weight268.44 g/mol
Exact Mass268.25
IUPAC Name(1S)-1-[1-[1-(2-methylpropyl)piperidin-4-yl]piperidin-4-yl]ethanol
SMILESCC(C)CN1CCC(N2CCC([C@H](C)O)CC2)CC1
InChIInChI=1S/C16H32N2O/c1-13(2)12-17-8-6-16(7-9-17)18-10-4-15(5-11-18)14(3)19/h13-16,19H,4-12H2,1-3H3/t14-/m0/s1
InChIKeyAROXWTKGNCJMAN-AWEZNQCLSA-N
XLogP2.20
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (1S)-1-[1-[1-(2-methylpropyl)piperidin-4-yl]piperidin-4-yl]ethanol 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-(2-methylpropyl)-4-[4-(2-methylpropyl)piperidin-1-yl]piperidine
CID 177321679
4-[4-(1-hydroxyethyl)piperidin-1-yl]cyclohexan-1-ol
CID 106839975
1-(1-ethylpiperidin-4-yl)ethanol
CID 588327
1-(2-methylpropyl)-4-[1-(2-methylpropyl)pyrrolidin-3-yl]piperazine
CID 155459870
(2S)-1-(4-piperidin-1-ylpiperidin-1-yl)propan-2-ol
CID 103934988
(1R)-1-[1-(2-hydroxyethyl)piperidin-4-yl]ethanol
CID 129386330
3-[[4-(1-hydroxyethyl)piperidin-1-yl]methyl]pentan-3-ol
CID 103935797
1-(4-piperidin-1-ylpiperidin-1-yl)-3-propan-2-yloxypropan-2-ol
CID 60966443
(3S,4S)-4-methyl-1-[1-(2-methylpropyl)piperidin-4-yl]pyrrolidine-3-carboxylic acid
CID 114086373
1-[4-(1-hydroxyethyl)piperidin-1-yl]-3-[(2-methylpropan-2-yl)oxy]propan-2-ol
CID 111116658
1-(1-ethylazetidin-3-yl)-4-(2-methylpropyl)piperazine
CID 156885108
4-(2,5-dimethylheptyl)-1-(2-methylpropyl)piperidine
CID 167107327

Frequently Asked Questions

What is the IUPAC name of (1S)-1-[1-[1-(2-methylpropyl)piperidin-4-yl]piperidin-4-yl]ethanol?
The IUPAC name of (1S)-1-[1-[1-(2-methylpropyl)piperidin-4-yl]piperidin-4-yl]ethanol (CID 95111576) is (1S)-1-[1-[1-(2-methylpropyl)piperidin-4-yl]piperidin-4-yl]ethanol.
What is the SMILES notation for (1S)-1-[1-[1-(2-methylpropyl)piperidin-4-yl]piperidin-4-yl]ethanol?
The canonical SMILES for (1S)-1-[1-[1-(2-methylpropyl)piperidin-4-yl]piperidin-4-yl]ethanol is CC(C)CN1CCC(N2CCC([C@H](C)O)CC2)CC1.
What is the InChIKey of (1S)-1-[1-[1-(2-methylpropyl)piperidin-4-yl]piperidin-4-yl]ethanol?
The InChIKey is AROXWTKGNCJMAN-AWEZNQCLSA-N. The full InChI is InChI=1S/C16H32N2O/c1-13(2)12-17-8-6-16(7-9-17)18-10-4-15(5-11-18)14(3)19/h13-16,19H,4-12H2,1-3H3/t14-/m0/s1.
What are the key properties of (1S)-1-[1-[1-(2-methylpropyl)piperidin-4-yl]piperidin-4-yl]ethanol?
(1S)-1-[1-[1-(2-methylpropyl)piperidin-4-yl]piperidin-4-yl]ethanol has a molecular weight of 268.44 g/mol, XLogP of 2.20, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-[1-[1-(2-methylpropyl)piperidin-4-yl]piperidin-4-yl]ethanol is sourced from PubChem (CID 95111576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).