N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-6-oxopiperidine-3-carboxamide

C12H20N2O4 — CID 103800436

IUPACN-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-6-oxopiperidine-3-carboxamide
SMILESCC1(C)OCC(CNC(=O)C2CCC(=O)NC2)O1
InChIInChI=1S/C12H20N2O4/c1-12(2)17-7-9(18-12)6-14-11(16)8-3-4-10(15)13-5-8/h8-9H,3-7H2,1-2H3,(H,13,15)(H,14,16)
InChIKeyKUZVETIKLWERNN-UHFFFAOYSA-N
MW256.30 g/mol
LogP-0.22
Rot. Bonds3

About N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-6-oxopiperidine-3-carboxamide

N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-6-oxopiperidine-3-carboxamide (PubChem CID 103800436) has the molecular formula C12H20N2O4 and a molecular weight of 256.30 g/mol. Its IUPAC name is N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-6-oxopiperidine-3-carboxamide.

Molecular Properties

Compound NameN-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-6-oxopiperidine-3-carboxamide
PubChem CID103800436
Molecular FormulaC12H20N2O4
Molecular Weight256.30 g/mol
Exact Mass256.14
IUPAC NameN-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-6-oxopiperidine-3-carboxamide
SMILESCC1(C)OCC(CNC(=O)C2CCC(=O)NC2)O1
InChIInChI=1S/C12H20N2O4/c1-12(2)17-7-9(18-12)6-14-11(16)8-3-4-10(15)13-5-8/h8-9H,3-7H2,1-2H3,(H,13,15)(H,14,16)
InChIKeyKUZVETIKLWERNN-UHFFFAOYSA-N
XLogP-0.22
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.30
LogP ≤ 5-0.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-6-oxopiperidine-3-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-methyloxetan-3-yl)methyl]-6-oxopiperidine-3-carboxamide
CID 78956601
4-(aminomethyl)-N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]cyclohexane-1-carboxamide
CID 104694629
N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]bicyclo[4.1.0]heptane-7-carboxamide
CID 103800557
N-(2,2-dicyclopropylethyl)-6-oxopiperidine-3-carboxamide
CID 79036656
N-[(2R)-2-hydroxypropyl]-6-oxopiperidine-3-carboxamide
CID 103884751
2-methyl-3-[(6-oxopiperidine-3-carbonyl)amino]propanoic acid
CID 83192791
N-[3-(dimethylamino)-3-oxopropyl]-6-oxopiperidine-3-carboxamide
CID 112728984
3-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-1,1-dimethylurea
CID 103800989
6-oxopiperidine-3-carbohydrazide
CID 126970948
N-(2,2-difluoro-3-hydroxypropyl)-6-oxopiperidine-3-carboxamide
CID 104857784
N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-4-iodobenzamide
CID 44756377
4-amino-N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]cyclopent-2-ene-1-carboxamide
CID 107389499

Frequently Asked Questions

What is the IUPAC name of N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-6-oxopiperidine-3-carboxamide?
The IUPAC name of N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-6-oxopiperidine-3-carboxamide (CID 103800436) is N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-6-oxopiperidine-3-carboxamide.
What is the SMILES notation for N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-6-oxopiperidine-3-carboxamide?
The canonical SMILES for N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-6-oxopiperidine-3-carboxamide is CC1(C)OCC(CNC(=O)C2CCC(=O)NC2)O1.
What is the InChIKey of N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-6-oxopiperidine-3-carboxamide?
The InChIKey is KUZVETIKLWERNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O4/c1-12(2)17-7-9(18-12)6-14-11(16)8-3-4-10(15)13-5-8/h8-9H,3-7H2,1-2H3,(H,13,15)(H,14,16).
What are the key properties of N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-6-oxopiperidine-3-carboxamide?
N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-6-oxopiperidine-3-carboxamide has a molecular weight of 256.30 g/mol, XLogP of -0.22, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-6-oxopiperidine-3-carboxamide is sourced from PubChem (CID 103800436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).