1-amino-4-(2-ethylpiperidin-1-yl)-2-methylpentan-2-ol

C13H28N2O — CID 64820664

IUPAC1-amino-4-(2-ethylpiperidin-1-yl)-2-methylpentan-2-ol
SMILESCCC1CCCCN1C(C)CC(C)(O)CN
InChIInChI=1S/C13H28N2O/c1-4-12-7-5-6-8-15(12)11(2)9-13(3,16)10-14/h11-12,16H,4-10,14H2,1-3H3
InChIKeyKIWUGGCVUIEEIC-UHFFFAOYSA-N
MW228.38 g/mol
LogP1.74
Rot. Bonds5

About 1-amino-4-(2-ethylpiperidin-1-yl)-2-methylpentan-2-ol

1-amino-4-(2-ethylpiperidin-1-yl)-2-methylpentan-2-ol (PubChem CID 64820664) has the molecular formula C13H28N2O and a molecular weight of 228.38 g/mol. Its IUPAC name is 1-amino-4-(2-ethylpiperidin-1-yl)-2-methylpentan-2-ol.

Molecular Properties

Compound Name1-amino-4-(2-ethylpiperidin-1-yl)-2-methylpentan-2-ol
PubChem CID64820664
Molecular FormulaC13H28N2O
Molecular Weight228.38 g/mol
Exact Mass228.22
IUPAC Name1-amino-4-(2-ethylpiperidin-1-yl)-2-methylpentan-2-ol
SMILESCCC1CCCCN1C(C)CC(C)(O)CN
InChIInChI=1S/C13H28N2O/c1-4-12-7-5-6-8-15(12)11(2)9-13(3,16)10-14/h11-12,16H,4-10,14H2,1-3H3
InChIKeyKIWUGGCVUIEEIC-UHFFFAOYSA-N
XLogP1.74
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.38
LogP ≤ 51.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-amino-4-(2-ethylpiperidin-1-yl)-2-methylpentan-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

4-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)-1-amino-2-methylpentan-2-ol
CID 64818883
4-(2-ethylpiperidin-1-yl)-2-methyl-2-(propylamino)pentanamide
CID 64727643
4-(2-ethylazepan-1-yl)-2-methyl-2-(propylamino)pentanamide
CID 104691662
3-(2-ethylazepan-1-yl)butanimidamide
CID 104690079
2-(2-ethylazepan-1-yl)-4,4-dimethylpentan-1-amine
CID 104689222
2-(cyclopropylamino)-4-(2-ethylazepan-1-yl)-2-methylpentanoic acid
CID 104691548
4-(2-ethylpyrrolidin-1-yl)-2-methyl-2-(propylamino)pentanoic acid
CID 64726316
3-(2-ethylpiperidin-1-yl)butanehydrazide
CID 63573262
N-tert-butyl-3-(2-ethylazepan-1-yl)butan-1-amine
CID 104692382
4-(2-ethylpyrrolidin-1-yl)pentan-1-amine
CID 62437661
3-amino-2-(2-ethylpiperidin-1-yl)propan-1-ol
CID 104710817
1-amino-2-methyl-4-(3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)pentan-2-ol
CID 79937647

Frequently Asked Questions

What is the IUPAC name of 1-amino-4-(2-ethylpiperidin-1-yl)-2-methylpentan-2-ol?
The IUPAC name of 1-amino-4-(2-ethylpiperidin-1-yl)-2-methylpentan-2-ol (CID 64820664) is 1-amino-4-(2-ethylpiperidin-1-yl)-2-methylpentan-2-ol.
What is the SMILES notation for 1-amino-4-(2-ethylpiperidin-1-yl)-2-methylpentan-2-ol?
The canonical SMILES for 1-amino-4-(2-ethylpiperidin-1-yl)-2-methylpentan-2-ol is CCC1CCCCN1C(C)CC(C)(O)CN.
What is the InChIKey of 1-amino-4-(2-ethylpiperidin-1-yl)-2-methylpentan-2-ol?
The InChIKey is KIWUGGCVUIEEIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O/c1-4-12-7-5-6-8-15(12)11(2)9-13(3,16)10-14/h11-12,16H,4-10,14H2,1-3H3.
What are the key properties of 1-amino-4-(2-ethylpiperidin-1-yl)-2-methylpentan-2-ol?
1-amino-4-(2-ethylpiperidin-1-yl)-2-methylpentan-2-ol has a molecular weight of 228.38 g/mol, XLogP of 1.74, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-4-(2-ethylpiperidin-1-yl)-2-methylpentan-2-ol is sourced from PubChem (CID 64820664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).