N,N-dimethylacetamide

C4H9NO — CID 71308854

IUPACN,N-dimethylacetamide
SMILESCN(C)[13C]([13CH3])=O
InChIInChI=1S/C4H9NO/c1-4(6)5(2)3/h1-3H3/i1+1,4+1
InChIKeyFXHOOIRPVKKKFG-VFZPYAPFSA-N
MW89.11 g/mol
LogP0.09
Rot. Bonds

About N,N-dimethylacetamide

N,N-dimethylacetamide (PubChem CID 71308854) has the molecular formula C4H9NO and a molecular weight of 89.11 g/mol. Its IUPAC name is N,N-dimethylacetamide.

Molecular Properties

Compound NameN,N-dimethylacetamide
PubChem CID71308854
Molecular FormulaC4H9NO
Molecular Weight89.11 g/mol
Exact Mass89.08
IUPAC NameN,N-dimethylacetamide
SMILESCN(C)[13C]([13CH3])=O
InChIInChI=1S/C4H9NO/c1-4(6)5(2)3/h1-3H3/i1+1,4+1
InChIKeyFXHOOIRPVKKKFG-VFZPYAPFSA-N
XLogP0.09
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50089.11
LogP ≤ 50.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Dimethylacetamide
CID 31374
N,N-Diethylacetamide
CID 12703
Propanamide, N,N-dimethyl-
CID 12965
N-Methyldiacetamide
CID 14214
N,N-Dimethylacetamide-d9
CID 22789542
2-Iodo-N,N-dimethylacetamide
CID 52050
N,N-dimethylbut-2-ynamide
CID 549168
N-Ethyl-N-methylacetamide
CID 13390905
Acetyltrimethylammonium bromide
CID 21377
N,N-Dimethylacetamide--water (1/1)
CID 21534740
Acetamide, N,N-dimethyl-, hydrochloride
CID 523006
N-Methoxymethyl-N-methylacetamide
CID 542250

Frequently Asked Questions

What is the IUPAC name of N,N-dimethylacetamide?
The IUPAC name of N,N-dimethylacetamide (CID 71308854) is N,N-dimethylacetamide.
What is the SMILES notation for N,N-dimethylacetamide?
The canonical SMILES for N,N-dimethylacetamide is CN(C)[13C]([13CH3])=O.
What is the InChIKey of N,N-dimethylacetamide?
The InChIKey is FXHOOIRPVKKKFG-VFZPYAPFSA-N. The full InChI is InChI=1S/C4H9NO/c1-4(6)5(2)3/h1-3H3/i1+1,4+1.
What are the key properties of N,N-dimethylacetamide?
N,N-dimethylacetamide has a molecular weight of 89.11 g/mol, XLogP of 0.09, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethylacetamide is sourced from PubChem (CID 71308854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).