4,6-dimethyl-2-(2-methylbutyl)piperidine-3-carboxamide

C13H26N2O — CID 106778748

IUPAC4,6-dimethyl-2-(2-methylbutyl)piperidine-3-carboxamide
SMILESCCC(C)CC1NC(C)CC(C)C1C(N)=O
InChIInChI=1S/C13H26N2O/c1-5-8(2)6-11-12(13(14)16)9(3)7-10(4)15-11/h8-12,15H,5-7H2,1-4H3,(H2,14,16)
InChIKeyKEZDKNYKUSMSEW-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.91
Rot. Bonds4

About 4,6-dimethyl-2-(2-methylbutyl)piperidine-3-carboxamide

4,6-dimethyl-2-(2-methylbutyl)piperidine-3-carboxamide (PubChem CID 106778748) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is 4,6-dimethyl-2-(2-methylbutyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name4,6-dimethyl-2-(2-methylbutyl)piperidine-3-carboxamide
PubChem CID106778748
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name4,6-dimethyl-2-(2-methylbutyl)piperidine-3-carboxamide
SMILESCCC(C)CC1NC(C)CC(C)C1C(N)=O
InChIInChI=1S/C13H26N2O/c1-5-8(2)6-11-12(13(14)16)9(3)7-10(4)15-11/h8-12,15H,5-7H2,1-4H3,(H2,14,16)
InChIKeyKEZDKNYKUSMSEW-UHFFFAOYSA-N
XLogP1.91
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4,6-dimethyl-2-(2-methylpentyl)piperidine-3-carboxamide
CID 106778689
2-[(4-fluorophenyl)methyl]-4,6-dimethylpiperidine-3-carboxamide
CID 106777741
2-[(2-methoxyphenyl)methyl]-4,6-dimethylpiperidine-3-carboxamide
CID 106778055
2-[(3-ethyl-1-methylpyrazol-5-yl)methyl]-4,6-dimethylpiperidine-3-carboxamide
CID 106779994
2-(7-bicyclo[4.2.0]octa-1,3,5-trienylmethyl)-4,6-dimethylpiperidine-3-carboxamide
CID 106780274
1-methyl-2-(2-methylbutyl)cyclopropane
CID 91076617
3-methyl-1-(2-methylcyclopropyl)pentan-1-amine
CID 65419955
1-methyl-4-(2-methylbutyl)-2-propan-2-ylcyclopentane
CID 123749319
1-ethyl-3-methyl-2-(2-methylbutyl)cyclobutane
CID 90801138
2-(2-methylbutyl)-4-propan-2-ylcyclohexane-1-carboxylic acid
CID 81020503
N,2-dimethyl-N-[(4-methylazetidin-2-yl)methyl]butanamide
CID 168995513
N-(1,3-dihydroxypropan-2-yl)-4-[(2S)-2-methylbutyl]piperidine-2-carboxamide
CID 163850863

Frequently Asked Questions

What is the IUPAC name of 4,6-dimethyl-2-(2-methylbutyl)piperidine-3-carboxamide?
The IUPAC name of 4,6-dimethyl-2-(2-methylbutyl)piperidine-3-carboxamide (CID 106778748) is 4,6-dimethyl-2-(2-methylbutyl)piperidine-3-carboxamide.
What is the SMILES notation for 4,6-dimethyl-2-(2-methylbutyl)piperidine-3-carboxamide?
The canonical SMILES for 4,6-dimethyl-2-(2-methylbutyl)piperidine-3-carboxamide is CCC(C)CC1NC(C)CC(C)C1C(N)=O.
What is the InChIKey of 4,6-dimethyl-2-(2-methylbutyl)piperidine-3-carboxamide?
The InChIKey is KEZDKNYKUSMSEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-5-8(2)6-11-12(13(14)16)9(3)7-10(4)15-11/h8-12,15H,5-7H2,1-4H3,(H2,14,16).
What are the key properties of 4,6-dimethyl-2-(2-methylbutyl)piperidine-3-carboxamide?
4,6-dimethyl-2-(2-methylbutyl)piperidine-3-carboxamide has a molecular weight of 226.36 g/mol, XLogP of 1.91, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dimethyl-2-(2-methylbutyl)piperidine-3-carboxamide is sourced from PubChem (CID 106778748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).