N,2-dimethyl-3-[methyl(3-oxopentan-2-yl)amino]propanamide

C11H22N2O2 — CID 106916625

IUPACN,2-dimethyl-3-[methyl(3-oxopentan-2-yl)amino]propanamide
SMILESCCC(=O)C(C)N(C)CC(C)C(=O)NC
InChIInChI=1S/C11H22N2O2/c1-6-10(14)9(3)13(5)7-8(2)11(15)12-4/h8-9H,6-7H2,1-5H3,(H,12,15)
InChIKeyPGQXCLFLIUFDNF-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.67
Rot. Bonds6

About N,2-dimethyl-3-[methyl(3-oxopentan-2-yl)amino]propanamide

N,2-dimethyl-3-[methyl(3-oxopentan-2-yl)amino]propanamide (PubChem CID 106916625) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is N,2-dimethyl-3-[methyl(3-oxopentan-2-yl)amino]propanamide.

Molecular Properties

Compound NameN,2-dimethyl-3-[methyl(3-oxopentan-2-yl)amino]propanamide
PubChem CID106916625
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC NameN,2-dimethyl-3-[methyl(3-oxopentan-2-yl)amino]propanamide
SMILESCCC(=O)C(C)N(C)CC(C)C(=O)NC
InChIInChI=1S/C11H22N2O2/c1-6-10(14)9(3)13(5)7-8(2)11(15)12-4/h8-9H,6-7H2,1-5H3,(H,12,15)
InChIKeyPGQXCLFLIUFDNF-UHFFFAOYSA-N
XLogP0.67
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 2-[methyl-[2-methyl-3-(methylamino)-3-oxopropyl]amino]propanoate
CID 103722524
2-[2-hydroxypropyl(methyl)amino]pentan-3-one
CID 64866283
(2S)-N,2-dimethyl-3-[methyl-[(2S)-1-oxo-1-(2,2,2-trifluoroethylamino)propan-2-yl]amino]propanamide
CID 97237748
3-[[1-(4-ethylphenyl)-1-oxopropan-2-yl]-methylamino]-N,2-dimethylpropanamide
CID 106916575
3-methyl-2-[methyl-[2-methyl-3-(methylamino)-3-oxopropyl]amino]butanoic acid
CID 106916274
methyl 2-methyl-3-[methyl-[1-(methylamino)-1-oxopropan-2-yl]amino]propanoate
CID 62013602
N,2-dimethyl-3-[methyl(2-oxobutyl)amino]propanamide
CID 106916646
N,2-dimethyl-3-[methyl-(3-methyl-2-oxopentyl)amino]propanamide
CID 106916626
2-methyl-3-[methyl-[2-methyl-3-(methylamino)-3-oxopropyl]amino]propanoic acid
CID 106916265
2-[2-aminopropyl(methyl)amino]-N-methylpropanamide
CID 63760672
N,2-dimethyl-3-oxopentanamide
CID 55299421
N,2-dimethyl-3-[methyl(methylsulfonyl)amino]propanamide
CID 103723774

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-3-[methyl(3-oxopentan-2-yl)amino]propanamide?
The IUPAC name of N,2-dimethyl-3-[methyl(3-oxopentan-2-yl)amino]propanamide (CID 106916625) is N,2-dimethyl-3-[methyl(3-oxopentan-2-yl)amino]propanamide.
What is the SMILES notation for N,2-dimethyl-3-[methyl(3-oxopentan-2-yl)amino]propanamide?
The canonical SMILES for N,2-dimethyl-3-[methyl(3-oxopentan-2-yl)amino]propanamide is CCC(=O)C(C)N(C)CC(C)C(=O)NC.
What is the InChIKey of N,2-dimethyl-3-[methyl(3-oxopentan-2-yl)amino]propanamide?
The InChIKey is PGQXCLFLIUFDNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-6-10(14)9(3)13(5)7-8(2)11(15)12-4/h8-9H,6-7H2,1-5H3,(H,12,15).
What are the key properties of N,2-dimethyl-3-[methyl(3-oxopentan-2-yl)amino]propanamide?
N,2-dimethyl-3-[methyl(3-oxopentan-2-yl)amino]propanamide has a molecular weight of 214.31 g/mol, XLogP of 0.67, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-3-[methyl(3-oxopentan-2-yl)amino]propanamide is sourced from PubChem (CID 106916625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).