N-methyl-N-[1-(methylamino)-3-oxopropan-2-yl]acetamide

C7H14N2O2 — CID 167152909

IUPACN-methyl-N-[1-(methylamino)-3-oxopropan-2-yl]acetamide
SMILESCNCC(C=O)N(C)C(C)=O
InChIInChI=1S/C7H14N2O2/c1-6(11)9(3)7(5-10)4-8-2/h5,7-8H,4H2,1-3H3
InChIKeyCZSULDLFHATGPY-UHFFFAOYSA-N
MW158.20 g/mol
LogP-0.75
Rot. Bonds4

About N-methyl-N-[1-(methylamino)-3-oxopropan-2-yl]acetamide

N-methyl-N-[1-(methylamino)-3-oxopropan-2-yl]acetamide (PubChem CID 167152909) has the molecular formula C7H14N2O2 and a molecular weight of 158.20 g/mol. Its IUPAC name is N-methyl-N-[1-(methylamino)-3-oxopropan-2-yl]acetamide.

Molecular Properties

Compound NameN-methyl-N-[1-(methylamino)-3-oxopropan-2-yl]acetamide
PubChem CID167152909
Molecular FormulaC7H14N2O2
Molecular Weight158.20 g/mol
Exact Mass158.11
IUPAC NameN-methyl-N-[1-(methylamino)-3-oxopropan-2-yl]acetamide
SMILESCNCC(C=O)N(C)C(C)=O
InChIInChI=1S/C7H14N2O2/c1-6(11)9(3)7(5-10)4-8-2/h5,7-8H,4H2,1-3H3
InChIKeyCZSULDLFHATGPY-UHFFFAOYSA-N
XLogP-0.75
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.20
LogP ≤ 5-0.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

N-methyl-N-[(2S)-4-methylsulfanyl-1-oxobutan-2-yl]acetamide
CID 54055812
N-methyl-N-(3-methyl-1-oxopentan-2-yl)acetamide
CID 19757608
ethane;1-(methylamino)propan-2-one;2-methylpropanal
CID 170710537
4-methyl-5-(methylamino)pentan-2-one
CID 20632141
N-[1-(diethylamino)ethyl]-N-methylacetamide
CID 141054197
(2S)-2-(methylamino)-4-oxopentanal
CID 59947269
4-[formyl(methyl)amino]-N-methyl-5-oxopentanamide
CID 156711657
N-[3,3-dimethyl-1-(methylamino)butan-2-yl]-N,3-dimethyl-2-oxobutanamide
CID 165156817
N-methyl-N-[(2S)-2-(methylamino)propyl]acetamide
CID 58006956
N-[1-[acetyl(methyl)amino]ethyl]acetamide
CID 166903607
N-methyl-2-(methylaminomethyl)-N-propan-2-ylbutanamide
CID 115188783
N-methyl-N-[1-(methylaminomethyl)cyclobutyl]acetamide
CID 171105856

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[1-(methylamino)-3-oxopropan-2-yl]acetamide?
The IUPAC name of N-methyl-N-[1-(methylamino)-3-oxopropan-2-yl]acetamide (CID 167152909) is N-methyl-N-[1-(methylamino)-3-oxopropan-2-yl]acetamide.
What is the SMILES notation for N-methyl-N-[1-(methylamino)-3-oxopropan-2-yl]acetamide?
The canonical SMILES for N-methyl-N-[1-(methylamino)-3-oxopropan-2-yl]acetamide is CNCC(C=O)N(C)C(C)=O.
What is the InChIKey of N-methyl-N-[1-(methylamino)-3-oxopropan-2-yl]acetamide?
The InChIKey is CZSULDLFHATGPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O2/c1-6(11)9(3)7(5-10)4-8-2/h5,7-8H,4H2,1-3H3.
What are the key properties of N-methyl-N-[1-(methylamino)-3-oxopropan-2-yl]acetamide?
N-methyl-N-[1-(methylamino)-3-oxopropan-2-yl]acetamide has a molecular weight of 158.20 g/mol, XLogP of -0.75, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[1-(methylamino)-3-oxopropan-2-yl]acetamide is sourced from PubChem (CID 167152909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).