N-[(4-methylpiperidin-4-yl)methyl]oxane-4-carboxamide

C13H24N2O2 — CID 113400555

IUPACN-[(4-methylpiperidin-4-yl)methyl]oxane-4-carboxamide
SMILESCC1(CNC(=O)C2CCOCC2)CCNCC1
InChIInChI=1S/C13H24N2O2/c1-13(4-6-14-7-5-13)10-15-12(16)11-2-8-17-9-3-11/h11,14H,2-10H2,1H3,(H,15,16)
InChIKeyXOAQGXBFEAGRSB-UHFFFAOYSA-N
MW240.35 g/mol
LogP0.92
Rot. Bonds3

About N-[(4-methylpiperidin-4-yl)methyl]oxane-4-carboxamide

N-[(4-methylpiperidin-4-yl)methyl]oxane-4-carboxamide (PubChem CID 113400555) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is N-[(4-methylpiperidin-4-yl)methyl]oxane-4-carboxamide.

Molecular Properties

Compound NameN-[(4-methylpiperidin-4-yl)methyl]oxane-4-carboxamide
PubChem CID113400555
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC NameN-[(4-methylpiperidin-4-yl)methyl]oxane-4-carboxamide
SMILESCC1(CNC(=O)C2CCOCC2)CCNCC1
InChIInChI=1S/C13H24N2O2/c1-13(4-6-14-7-5-13)10-15-12(16)11-2-8-17-9-3-11/h11,14H,2-10H2,1H3,(H,15,16)
InChIKeyXOAQGXBFEAGRSB-UHFFFAOYSA-N
XLogP0.92
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[(4-methylpiperidin-4-yl)methyl]oxane-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-[(4-methylpiperidin-4-yl)methyl]cycloheptanecarboxamide
CID 91660383
N-[(4-methylpiperidin-4-yl)methyl]cycloheptanecarboxamide;hydrochloride
CID 91660382
N-[(1-methylcyclopropyl)methyl]cyclopropanecarboxamide
CID 103722140
1-[(4-methylpiperidin-4-yl)methyl]-3-(oxolan-3-yl)urea
CID 113400570
N-[(1-methylcyclopropyl)methyl]cyclobutanecarboxamide
CID 127018359
(3S)-N-[(1-methylcyclopropyl)methyl]pyrrolidine-3-carboxamide
CID 131134696
N-[(4-methylpiperidin-4-yl)methyl]morpholine-4-carboxamide
CID 113400569
N-[(4-methylpiperidin-4-yl)methyl]-4-(oxan-4-ylmethyl)piperazine-1-carboxamide
CID 128826057
N-[(4-methyloxan-4-yl)methyl]-6-oxopiperidine-3-carboxamide
CID 113252970
N-(2-piperidin-4-ylethyl)oxane-4-carboxamide
CID 62907394
4-[(3-methyloxolan-3-yl)methylcarbamoyl]cyclohexane-1-carboxylic acid
CID 120673614
ethane;formaldehyde;N-[(1-methylcyclohexyl)methyl]cyclohexanecarboxamide
CID 90789963

Frequently Asked Questions

What is the IUPAC name of N-[(4-methylpiperidin-4-yl)methyl]oxane-4-carboxamide?
The IUPAC name of N-[(4-methylpiperidin-4-yl)methyl]oxane-4-carboxamide (CID 113400555) is N-[(4-methylpiperidin-4-yl)methyl]oxane-4-carboxamide.
What is the SMILES notation for N-[(4-methylpiperidin-4-yl)methyl]oxane-4-carboxamide?
The canonical SMILES for N-[(4-methylpiperidin-4-yl)methyl]oxane-4-carboxamide is CC1(CNC(=O)C2CCOCC2)CCNCC1.
What is the InChIKey of N-[(4-methylpiperidin-4-yl)methyl]oxane-4-carboxamide?
The InChIKey is XOAQGXBFEAGRSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-13(4-6-14-7-5-13)10-15-12(16)11-2-8-17-9-3-11/h11,14H,2-10H2,1H3,(H,15,16).
What are the key properties of N-[(4-methylpiperidin-4-yl)methyl]oxane-4-carboxamide?
N-[(4-methylpiperidin-4-yl)methyl]oxane-4-carboxamide has a molecular weight of 240.35 g/mol, XLogP of 0.92, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methylpiperidin-4-yl)methyl]oxane-4-carboxamide is sourced from PubChem (CID 113400555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).