3-ethyl-1-[(1,2,5-trimethylpiperidin-4-yl)amino]pentan-2-ol

C15H32N2O — CID 103783038

IUPAC3-ethyl-1-[(1,2,5-trimethylpiperidin-4-yl)amino]pentan-2-ol
SMILESCCC(CC)C(O)CNC1CC(C)N(C)CC1C
InChIInChI=1S/C15H32N2O/c1-6-13(7-2)15(18)9-16-14-8-12(4)17(5)10-11(14)3/h11-16,18H,6-10H2,1-5H3
InChIKeyPRURDBCMWCHGEW-UHFFFAOYSA-N
MW256.43 g/mol
LogP2.10
Rot. Bonds6

About 3-ethyl-1-[(1,2,5-trimethylpiperidin-4-yl)amino]pentan-2-ol

3-ethyl-1-[(1,2,5-trimethylpiperidin-4-yl)amino]pentan-2-ol (PubChem CID 103783038) has the molecular formula C15H32N2O and a molecular weight of 256.43 g/mol. Its IUPAC name is 3-ethyl-1-[(1,2,5-trimethylpiperidin-4-yl)amino]pentan-2-ol.

Molecular Properties

Compound Name3-ethyl-1-[(1,2,5-trimethylpiperidin-4-yl)amino]pentan-2-ol
PubChem CID103783038
Molecular FormulaC15H32N2O
Molecular Weight256.43 g/mol
Exact Mass256.25
IUPAC Name3-ethyl-1-[(1,2,5-trimethylpiperidin-4-yl)amino]pentan-2-ol
SMILESCCC(CC)C(O)CNC1CC(C)N(C)CC1C
InChIInChI=1S/C15H32N2O/c1-6-13(7-2)15(18)9-16-14-8-12(4)17(5)10-11(14)3/h11-16,18H,6-10H2,1-5H3
InChIKeyPRURDBCMWCHGEW-UHFFFAOYSA-N
XLogP2.10
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.43
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-ethyl-1-[(1,2,5-trimethylpiperidin-4-yl)amino]pentan-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

(2S)-1-[(1,2,5-trimethylpiperidin-4-yl)amino]propan-2-ol
CID 103906573
(2S)-1-[[(2R,4R,5S)-1,2,5-trimethylpiperidin-4-yl]amino]propan-2-ol
CID 124526610
(1S)-1-phenyl-2-[[(2R,4R,5R)-1,2,5-trimethylpiperidin-4-yl]amino]ethanol
CID 124739387
2-[[(2R,4S,5R)-1,2,5-trimethylpiperidin-4-yl]amino]ethanol
CID 93258534
(2R,4S,5S)-1,2,5-trimethyl-N-pentylpiperidin-4-amine
CID 93258445
2-[(1,2,5-trimethylpiperidin-4-yl)amino]acetamide
CID 43665297
N-(2-methoxy-2-methylpropyl)-1,2,5-trimethylpiperidin-4-amine
CID 115728653
N-(2-ethyl-2-methylsulfanylbutyl)-1,2,5-trimethylpiperidin-4-amine
CID 103787192
(2R,4S,5R)-N-cyclopentyl-1,2,5-trimethylpiperidin-4-amine
CID 93258430
N,N-dimethyl-1-phenyl-N'-(1,2,5-trimethylpiperidin-4-yl)ethane-1,2-diamine
CID 43665443
(2R)-2-[[(2R,4R,5S)-1,2,5-trimethylpiperidin-4-yl]amino]propan-1-ol
CID 124526611
N'-(1,2,5-trimethylpiperidin-4-yl)propane-1,3-diamine
CID 60890113

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-[(1,2,5-trimethylpiperidin-4-yl)amino]pentan-2-ol?
The IUPAC name of 3-ethyl-1-[(1,2,5-trimethylpiperidin-4-yl)amino]pentan-2-ol (CID 103783038) is 3-ethyl-1-[(1,2,5-trimethylpiperidin-4-yl)amino]pentan-2-ol.
What is the SMILES notation for 3-ethyl-1-[(1,2,5-trimethylpiperidin-4-yl)amino]pentan-2-ol?
The canonical SMILES for 3-ethyl-1-[(1,2,5-trimethylpiperidin-4-yl)amino]pentan-2-ol is CCC(CC)C(O)CNC1CC(C)N(C)CC1C.
What is the InChIKey of 3-ethyl-1-[(1,2,5-trimethylpiperidin-4-yl)amino]pentan-2-ol?
The InChIKey is PRURDBCMWCHGEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2O/c1-6-13(7-2)15(18)9-16-14-8-12(4)17(5)10-11(14)3/h11-16,18H,6-10H2,1-5H3.
What are the key properties of 3-ethyl-1-[(1,2,5-trimethylpiperidin-4-yl)amino]pentan-2-ol?
3-ethyl-1-[(1,2,5-trimethylpiperidin-4-yl)amino]pentan-2-ol has a molecular weight of 256.43 g/mol, XLogP of 2.10, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-[(1,2,5-trimethylpiperidin-4-yl)amino]pentan-2-ol is sourced from PubChem (CID 103783038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).