N-(3-hydroxy-4-methoxybutyl)-2-methylpiperidine-4-carboxamide

C12H24N2O3 — CID 106832212

IUPACN-(3-hydroxy-4-methoxybutyl)-2-methylpiperidine-4-carboxamide
SMILESCOCC(O)CCNC(=O)C1CCNC(C)C1
InChIInChI=1S/C12H24N2O3/c1-9-7-10(3-5-13-9)12(16)14-6-4-11(15)8-17-2/h9-11,13,15H,3-8H2,1-2H3,(H,14,16)
InChIKeyDYIIWNKHZVHBSL-UHFFFAOYSA-N
MW244.33 g/mol
LogP-0.11
Rot. Bonds6

About N-(3-hydroxy-4-methoxybutyl)-2-methylpiperidine-4-carboxamide

N-(3-hydroxy-4-methoxybutyl)-2-methylpiperidine-4-carboxamide (PubChem CID 106832212) has the molecular formula C12H24N2O3 and a molecular weight of 244.33 g/mol. Its IUPAC name is N-(3-hydroxy-4-methoxybutyl)-2-methylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-(3-hydroxy-4-methoxybutyl)-2-methylpiperidine-4-carboxamide
PubChem CID106832212
Molecular FormulaC12H24N2O3
Molecular Weight244.33 g/mol
Exact Mass244.18
IUPAC NameN-(3-hydroxy-4-methoxybutyl)-2-methylpiperidine-4-carboxamide
SMILESCOCC(O)CCNC(=O)C1CCNC(C)C1
InChIInChI=1S/C12H24N2O3/c1-9-7-10(3-5-13-9)12(16)14-6-4-11(15)8-17-2/h9-11,13,15H,3-8H2,1-2H3,(H,14,16)
InChIKeyDYIIWNKHZVHBSL-UHFFFAOYSA-N
XLogP-0.11
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.33
LogP ≤ 5-0.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-(3-hydroxy-4-methoxybutyl)-2-methylpiperidine-4-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

N-(3-hydroxy-4-methoxybutyl)-2-methylpyrrolidine-3-carboxamide
CID 106247563
2-hydroxy-4-[(2-methylpiperidine-4-carbonyl)amino]butanoic acid
CID 114006821
(2S)-N-(3-hydroxy-4-methoxybutyl)pyrrolidine-2-carboxamide
CID 106247580
3-amino-N-(3-hydroxy-4-methoxybutyl)cyclohexane-1-carboxamide
CID 113423463
N-(2-hydroxyethyl)-2-methylpiperidine-4-carboxamide
CID 106738732
(2S,4S)-2-methyl-N-[2-[methyl(propan-2-yl)amino]ethyl]piperidine-4-carboxamide
CID 120635200
(2S,4S)-N-(4-ethoxybutyl)-2-methylpiperidine-4-carboxamide
CID 120622256
(2S,4S)-N-[(2S)-2-hydroxypropyl]-2-methylpiperidine-4-carboxamide
CID 130877690
(2S,4S)-N-(2-cyclopropylethyl)-2-methylpiperidine-4-carboxamide
CID 120633867
N-(3-hydroxy-4-methoxybutyl)cyclohex-3-ene-1-carboxamide
CID 103876947
(2S,4S)-N-(1-methoxyhexan-2-yl)-2-methylpiperidine-4-carboxamide
CID 120634648
(3S,4S)-N-(3-hydroxy-4-methoxybutyl)-4-methylpyrrolidine-3-carboxamide
CID 106247472

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxy-4-methoxybutyl)-2-methylpiperidine-4-carboxamide?
The IUPAC name of N-(3-hydroxy-4-methoxybutyl)-2-methylpiperidine-4-carboxamide (CID 106832212) is N-(3-hydroxy-4-methoxybutyl)-2-methylpiperidine-4-carboxamide.
What is the SMILES notation for N-(3-hydroxy-4-methoxybutyl)-2-methylpiperidine-4-carboxamide?
The canonical SMILES for N-(3-hydroxy-4-methoxybutyl)-2-methylpiperidine-4-carboxamide is COCC(O)CCNC(=O)C1CCNC(C)C1.
What is the InChIKey of N-(3-hydroxy-4-methoxybutyl)-2-methylpiperidine-4-carboxamide?
The InChIKey is DYIIWNKHZVHBSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O3/c1-9-7-10(3-5-13-9)12(16)14-6-4-11(15)8-17-2/h9-11,13,15H,3-8H2,1-2H3,(H,14,16).
What are the key properties of N-(3-hydroxy-4-methoxybutyl)-2-methylpiperidine-4-carboxamide?
N-(3-hydroxy-4-methoxybutyl)-2-methylpiperidine-4-carboxamide has a molecular weight of 244.33 g/mol, XLogP of -0.11, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxy-4-methoxybutyl)-2-methylpiperidine-4-carboxamide is sourced from PubChem (CID 106832212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).