N-(3-amino-2,2-dimethylpropyl)-N-methyl-6-oxopiperidine-3-carboxamide

C12H23N3O2 — CID 81484591

IUPACN-(3-amino-2,2-dimethylpropyl)-N-methyl-6-oxopiperidine-3-carboxamide
SMILESCN(CC(C)(C)CN)C(=O)C1CCC(=O)NC1
InChIInChI=1S/C12H23N3O2/c1-12(2,7-13)8-15(3)11(17)9-4-5-10(16)14-6-9/h9H,4-8,13H2,1-3H3,(H,14,16)
InChIKeyMFEDUIHFQOCAGR-UHFFFAOYSA-N
MW241.33 g/mol
LogP-0.04
Rot. Bonds4

About N-(3-amino-2,2-dimethylpropyl)-N-methyl-6-oxopiperidine-3-carboxamide

N-(3-amino-2,2-dimethylpropyl)-N-methyl-6-oxopiperidine-3-carboxamide (PubChem CID 81484591) has the molecular formula C12H23N3O2 and a molecular weight of 241.33 g/mol. Its IUPAC name is N-(3-amino-2,2-dimethylpropyl)-N-methyl-6-oxopiperidine-3-carboxamide.

Molecular Properties

Compound NameN-(3-amino-2,2-dimethylpropyl)-N-methyl-6-oxopiperidine-3-carboxamide
PubChem CID81484591
Molecular FormulaC12H23N3O2
Molecular Weight241.33 g/mol
Exact Mass241.18
IUPAC NameN-(3-amino-2,2-dimethylpropyl)-N-methyl-6-oxopiperidine-3-carboxamide
SMILESCN(CC(C)(C)CN)C(=O)C1CCC(=O)NC1
InChIInChI=1S/C12H23N3O2/c1-12(2,7-13)8-15(3)11(17)9-4-5-10(16)14-6-9/h9H,4-8,13H2,1-3H3,(H,14,16)
InChIKeyMFEDUIHFQOCAGR-UHFFFAOYSA-N
XLogP-0.04
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 5-0.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-amino-2,2-dimethylpropyl)-N-methyl-6-oxopiperidine-3-carboxamide;hydrochloride
CID 119655986
(2S)-N-(3-amino-2,2-dimethylpropyl)-N-methyl-5-oxopyrrolidine-2-carboxamide;hydrochloride
CID 119655849
N-methyl-N-(2-methylbutan-2-yl)-6-oxopiperidine-3-carboxamide
CID 78994366
N-methyl-6-oxo-N-(piperidin-4-ylmethyl)piperidine-3-carboxamide
CID 83192838
N-(3-hydroxybutyl)-N-methyl-6-oxopiperidine-3-carboxamide
CID 115691430
N-benzyl-N-methyl-6-oxopiperidine-3-carboxamide
CID 74464257
N-[(4-fluorophenyl)methyl]-N-methyl-6-oxopiperidine-3-carboxamide
CID 112728353
N-[(2-hydroxycyclopentyl)methyl]-N-methyl-6-oxopiperidine-3-carboxamide
CID 109400314
N-methyl-6-oxo-N-[2-oxo-2-(propylamino)ethyl]piperidine-3-carboxamide
CID 112728459
N-[(4-bromophenyl)methyl]-N-methyl-6-oxopiperidine-3-carboxamide
CID 112728718
N-cyclopropyl-6-oxo-N-(2,2,2-trifluoroethyl)piperidine-3-carboxamide
CID 78971176
N-(1-amino-2-cyclopropylpropan-2-yl)-6-oxopiperidine-3-carboxamide
CID 81486889

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2,2-dimethylpropyl)-N-methyl-6-oxopiperidine-3-carboxamide?
The IUPAC name of N-(3-amino-2,2-dimethylpropyl)-N-methyl-6-oxopiperidine-3-carboxamide (CID 81484591) is N-(3-amino-2,2-dimethylpropyl)-N-methyl-6-oxopiperidine-3-carboxamide.
What is the SMILES notation for N-(3-amino-2,2-dimethylpropyl)-N-methyl-6-oxopiperidine-3-carboxamide?
The canonical SMILES for N-(3-amino-2,2-dimethylpropyl)-N-methyl-6-oxopiperidine-3-carboxamide is CN(CC(C)(C)CN)C(=O)C1CCC(=O)NC1.
What is the InChIKey of N-(3-amino-2,2-dimethylpropyl)-N-methyl-6-oxopiperidine-3-carboxamide?
The InChIKey is MFEDUIHFQOCAGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O2/c1-12(2,7-13)8-15(3)11(17)9-4-5-10(16)14-6-9/h9H,4-8,13H2,1-3H3,(H,14,16).
What are the key properties of N-(3-amino-2,2-dimethylpropyl)-N-methyl-6-oxopiperidine-3-carboxamide?
N-(3-amino-2,2-dimethylpropyl)-N-methyl-6-oxopiperidine-3-carboxamide has a molecular weight of 241.33 g/mol, XLogP of -0.04, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-2,2-dimethylpropyl)-N-methyl-6-oxopiperidine-3-carboxamide is sourced from PubChem (CID 81484591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).