2-[2-(1-hydroxyethyl)piperidin-1-yl]-N-propylacetamide

C12H24N2O2 — CID 111107007

IUPAC2-[2-(1-hydroxyethyl)piperidin-1-yl]-N-propylacetamide
SMILESCCCNC(=O)CN1CCCCC1C(C)O
InChIInChI=1S/C12H24N2O2/c1-3-7-13-12(16)9-14-8-5-4-6-11(14)10(2)15/h10-11,15H,3-9H2,1-2H3,(H,13,16)
InChIKeyYODJLHJQZZSWHO-UHFFFAOYSA-N
MW228.34 g/mol
LogP0.75
Rot. Bonds5

About 2-[2-(1-hydroxyethyl)piperidin-1-yl]-N-propylacetamide

2-[2-(1-hydroxyethyl)piperidin-1-yl]-N-propylacetamide (PubChem CID 111107007) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 2-[2-(1-hydroxyethyl)piperidin-1-yl]-N-propylacetamide.

Molecular Properties

Compound Name2-[2-(1-hydroxyethyl)piperidin-1-yl]-N-propylacetamide
PubChem CID111107007
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name2-[2-(1-hydroxyethyl)piperidin-1-yl]-N-propylacetamide
SMILESCCCNC(=O)CN1CCCCC1C(C)O
InChIInChI=1S/C12H24N2O2/c1-3-7-13-12(16)9-14-8-5-4-6-11(14)10(2)15/h10-11,15H,3-9H2,1-2H3,(H,13,16)
InChIKeyYODJLHJQZZSWHO-UHFFFAOYSA-N
XLogP0.75
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 50.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[2-(1-hydroxyethyl)piperidin-1-yl]-N-propylacetamide 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

2-[2-(1-hydroxyethyl)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide
CID 111107052
2-[2-(1-aminoethyl)piperidin-1-yl]-N-butylacetamide
CID 63255648
N-cyclopentyl-2-[(2S)-2-[(1R)-1-hydroxyethyl]piperidin-1-yl]acetamide
CID 95321220
N-(2-methylpropyl)-2-[2-[1-(propylamino)ethyl]piperidin-1-yl]acetamide
CID 63854873
1-[2-oxo-2-(propylamino)ethyl]azepane-2-carboxylic acid
CID 64564538
2-(5-methyl-2-propan-2-ylazepan-1-yl)-N-propylacetamide
CID 86966628
N-ethyl-3-[2-(1-hydroxyethyl)piperidin-1-yl]propanamide
CID 111107076
N-(2,5-dimethylphenyl)-2-[2-(1-hydroxyethyl)piperidin-1-yl]acetamide
CID 111107012
2-[2-(1-hydroxyethyl)piperidin-1-yl]-N-(3,4,5-trimethylthiophen-2-yl)acetamide
CID 111487922
tert-butyl 2-[2-(1-hydroxyethyl)piperidin-1-yl]acetate
CID 111106840
N-[[(5R,7R)-3-bromo-1-adamantyl]methyl]-2-[(2R)-2-[(1R)-1-hydroxyethyl]piperidin-1-yl]acetamide
CID 124857570
2-[2-(1-aminoethyl)piperidin-1-yl]-N-(3-propan-2-yloxypropyl)acetamide
CID 63256081

Frequently Asked Questions

What is the IUPAC name of 2-[2-(1-hydroxyethyl)piperidin-1-yl]-N-propylacetamide?
The IUPAC name of 2-[2-(1-hydroxyethyl)piperidin-1-yl]-N-propylacetamide (CID 111107007) is 2-[2-(1-hydroxyethyl)piperidin-1-yl]-N-propylacetamide.
What is the SMILES notation for 2-[2-(1-hydroxyethyl)piperidin-1-yl]-N-propylacetamide?
The canonical SMILES for 2-[2-(1-hydroxyethyl)piperidin-1-yl]-N-propylacetamide is CCCNC(=O)CN1CCCCC1C(C)O.
What is the InChIKey of 2-[2-(1-hydroxyethyl)piperidin-1-yl]-N-propylacetamide?
The InChIKey is YODJLHJQZZSWHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-3-7-13-12(16)9-14-8-5-4-6-11(14)10(2)15/h10-11,15H,3-9H2,1-2H3,(H,13,16).
What are the key properties of 2-[2-(1-hydroxyethyl)piperidin-1-yl]-N-propylacetamide?
2-[2-(1-hydroxyethyl)piperidin-1-yl]-N-propylacetamide has a molecular weight of 228.34 g/mol, XLogP of 0.75, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(1-hydroxyethyl)piperidin-1-yl]-N-propylacetamide is sourced from PubChem (CID 111107007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).