3-hydroxy-N-[3-(2-methylpropoxy)propyl]piperidine-1-carboxamide

C13H26N2O3 — CID 110882664

IUPAC3-hydroxy-N-[3-(2-methylpropoxy)propyl]piperidine-1-carboxamide
SMILESCC(C)COCCCNC(=O)N1CCCC(O)C1
InChIInChI=1S/C13H26N2O3/c1-11(2)10-18-8-4-6-14-13(17)15-7-3-5-12(16)9-15/h11-12,16H,3-10H2,1-2H3,(H,14,17)
InChIKeyUGOHDVADXYGZNI-UHFFFAOYSA-N
MW258.36 g/mol
LogP1.22
Rot. Bonds6

About 3-hydroxy-N-[3-(2-methylpropoxy)propyl]piperidine-1-carboxamide

3-hydroxy-N-[3-(2-methylpropoxy)propyl]piperidine-1-carboxamide (PubChem CID 110882664) has the molecular formula C13H26N2O3 and a molecular weight of 258.36 g/mol. Its IUPAC name is 3-hydroxy-N-[3-(2-methylpropoxy)propyl]piperidine-1-carboxamide.

Molecular Properties

Compound Name3-hydroxy-N-[3-(2-methylpropoxy)propyl]piperidine-1-carboxamide
PubChem CID110882664
Molecular FormulaC13H26N2O3
Molecular Weight258.36 g/mol
Exact Mass258.19
IUPAC Name3-hydroxy-N-[3-(2-methylpropoxy)propyl]piperidine-1-carboxamide
SMILESCC(C)COCCCNC(=O)N1CCCC(O)C1
InChIInChI=1S/C13H26N2O3/c1-11(2)10-18-8-4-6-14-13(17)15-7-3-5-12(16)9-15/h11-12,16H,3-10H2,1-2H3,(H,14,17)
InChIKeyUGOHDVADXYGZNI-UHFFFAOYSA-N
XLogP1.22
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 3-hydroxy-N-[3-(2-methylpropoxy)propyl]piperidine-1-carboxamide 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

3-hydroxy-N-(2-hydroxyethyl)piperidine-1-carboxamide
CID 130943838
3-methyl-N-(3-propan-2-yloxypropyl)piperidine-1-carboxamide
CID 86811915
N-[3-(4-chloro-2-methylphenoxy)propyl]-3-hydroxypiperidine-1-carboxamide
CID 110904200
3-[1-(3-ethoxypropylcarbamoyl)piperidin-3-yl]butanoic acid
CID 81048987
N-(2-cyclohexylethyl)-3-hydroxypiperidine-1-carboxamide
CID 110896376
3-hydroxy-N-[3-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)propyl]piperidine-1-carboxamide
CID 110911744
(3R)-1-(5-methylhexylcarbamoyl)piperidine-3-carboxylic acid
CID 113287747
3-hydroxy-N-[2-(3-methylpiperidin-1-yl)ethyl]piperidine-1-carboxamide
CID 110896167
3-hydroxy-N-[[2-(3-methylbutoxy)phenyl]methyl]piperidine-1-carboxamide
CID 110922264
(3S)-1-[2-(3-methylbutoxy)ethylcarbamoyl]piperidine-3-carboxylic acid
CID 81125959
(3R)-N-[(2R)-2-ethylhexyl]-3-hydroxypiperidine-1-carboxamide
CID 97027498
N-(2-ethylhexyl)-3-hydroxypiperidine-1-carboxamide
CID 71943752

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-N-[3-(2-methylpropoxy)propyl]piperidine-1-carboxamide?
The IUPAC name of 3-hydroxy-N-[3-(2-methylpropoxy)propyl]piperidine-1-carboxamide (CID 110882664) is 3-hydroxy-N-[3-(2-methylpropoxy)propyl]piperidine-1-carboxamide.
What is the SMILES notation for 3-hydroxy-N-[3-(2-methylpropoxy)propyl]piperidine-1-carboxamide?
The canonical SMILES for 3-hydroxy-N-[3-(2-methylpropoxy)propyl]piperidine-1-carboxamide is CC(C)COCCCNC(=O)N1CCCC(O)C1.
What is the InChIKey of 3-hydroxy-N-[3-(2-methylpropoxy)propyl]piperidine-1-carboxamide?
The InChIKey is UGOHDVADXYGZNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O3/c1-11(2)10-18-8-4-6-14-13(17)15-7-3-5-12(16)9-15/h11-12,16H,3-10H2,1-2H3,(H,14,17).
What are the key properties of 3-hydroxy-N-[3-(2-methylpropoxy)propyl]piperidine-1-carboxamide?
3-hydroxy-N-[3-(2-methylpropoxy)propyl]piperidine-1-carboxamide has a molecular weight of 258.36 g/mol, XLogP of 1.22, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-N-[3-(2-methylpropoxy)propyl]piperidine-1-carboxamide is sourced from PubChem (CID 110882664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).