N-[2-(3,5-dimethylpiperidin-1-yl)-2-methylpropyl]-2-methyl-3-(methylamino)propanamide

C16H33N3O — CID 119863449

IUPACN-[2-(3,5-dimethylpiperidin-1-yl)-2-methylpropyl]-2-methyl-3-(methylamino)propanamide
SMILESCNCC(C)C(=O)NCC(C)(C)N1CC(C)CC(C)C1
InChIInChI=1S/C16H33N3O/c1-12-7-13(2)10-19(9-12)16(4,5)11-18-15(20)14(3)8-17-6/h12-14,17H,7-11H2,1-6H3,(H,18,20)
InChIKeyWGTJKAHJWBYTJK-UHFFFAOYSA-N
MW283.46 g/mol
LogP1.71
Rot. Bonds6

About N-[2-(3,5-dimethylpiperidin-1-yl)-2-methylpropyl]-2-methyl-3-(methylamino)propanamide

N-[2-(3,5-dimethylpiperidin-1-yl)-2-methylpropyl]-2-methyl-3-(methylamino)propanamide (PubChem CID 119863449) has the molecular formula C16H33N3O and a molecular weight of 283.46 g/mol. Its IUPAC name is N-[2-(3,5-dimethylpiperidin-1-yl)-2-methylpropyl]-2-methyl-3-(methylamino)propanamide.

Molecular Properties

Compound NameN-[2-(3,5-dimethylpiperidin-1-yl)-2-methylpropyl]-2-methyl-3-(methylamino)propanamide
PubChem CID119863449
Molecular FormulaC16H33N3O
Molecular Weight283.46 g/mol
Exact Mass283.26
IUPAC NameN-[2-(3,5-dimethylpiperidin-1-yl)-2-methylpropyl]-2-methyl-3-(methylamino)propanamide
SMILESCNCC(C)C(=O)NCC(C)(C)N1CC(C)CC(C)C1
InChIInChI=1S/C16H33N3O/c1-12-7-13(2)10-19(9-12)16(4,5)11-18-15(20)14(3)8-17-6/h12-14,17H,7-11H2,1-6H3,(H,18,20)
InChIKeyWGTJKAHJWBYTJK-UHFFFAOYSA-N
XLogP1.71
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.46
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-(dimethylamino)ethyl)-2-oxopiperidine-3-carboxamide
CID 3623770
1-Piperidinepropionamide, N-(1,1,3,3-tetramethylbutyl)-, hydrochloride
CID 3065263
4-Methyl-1-(piperazin-1-yl)pentan-1-one
CID 20596588
2-methyl-N-[3-[2-(3-methylpiperidin-1-yl)propylamino]-3-oxopropyl]cyclopropane-1-carboxamide
CID 51081022
3-Amino-1-(3-methylpiperidin-1-yl)propan-1-one hydrochloride
CID 56831835
(2S)-2-amino-1-(3-((dimethylamino)methyl)piperidin-1-yl)-3-methylbutan-1-one
CID 66568038
N-[[1-(4-ethylpiperazin-1-yl)cyclohexyl]methyl]-2-methylpropanamide
CID 35579847
N-[3-[(3S)-3-methylpiperidin-1-yl]-3-oxopropyl]acetamide
CID 40233359
N~3~-acetyl-N~1~-[1-(cyclohexylmethyl)-3-piperidinyl]-beta-alaninamide
CID 45207648
2-(3,5-dimethylpiperidin-1-yl)-N-propylpropanamide
CID 47012774
2-[(1-acetyl-3-ethylpiperidin-4-yl)amino]-N-pentan-2-ylpropanamide
CID 71927682
N-[(1-methyl-4-piperidin-1-ylpiperidin-4-yl)methyl]pentanamide
CID 72125474

Frequently Asked Questions

What is the IUPAC name of N-[2-(3,5-dimethylpiperidin-1-yl)-2-methylpropyl]-2-methyl-3-(methylamino)propanamide?
The IUPAC name of N-[2-(3,5-dimethylpiperidin-1-yl)-2-methylpropyl]-2-methyl-3-(methylamino)propanamide (CID 119863449) is N-[2-(3,5-dimethylpiperidin-1-yl)-2-methylpropyl]-2-methyl-3-(methylamino)propanamide.
What is the SMILES notation for N-[2-(3,5-dimethylpiperidin-1-yl)-2-methylpropyl]-2-methyl-3-(methylamino)propanamide?
The canonical SMILES for N-[2-(3,5-dimethylpiperidin-1-yl)-2-methylpropyl]-2-methyl-3-(methylamino)propanamide is CNCC(C)C(=O)NCC(C)(C)N1CC(C)CC(C)C1.
What is the InChIKey of N-[2-(3,5-dimethylpiperidin-1-yl)-2-methylpropyl]-2-methyl-3-(methylamino)propanamide?
The InChIKey is WGTJKAHJWBYTJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33N3O/c1-12-7-13(2)10-19(9-12)16(4,5)11-18-15(20)14(3)8-17-6/h12-14,17H,7-11H2,1-6H3,(H,18,20).
What are the key properties of N-[2-(3,5-dimethylpiperidin-1-yl)-2-methylpropyl]-2-methyl-3-(methylamino)propanamide?
N-[2-(3,5-dimethylpiperidin-1-yl)-2-methylpropyl]-2-methyl-3-(methylamino)propanamide has a molecular weight of 283.46 g/mol, XLogP of 1.71, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3,5-dimethylpiperidin-1-yl)-2-methylpropyl]-2-methyl-3-(methylamino)propanamide is sourced from PubChem (CID 119863449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).