N,N-dimethylformamide;2-methylpropanamide

C7H16N2O2 — CID 87581099

IUPACN,N-dimethylformamide;2-methylpropanamide
SMILESCC(C)C(N)=O.CN(C)C=O
InChIInChI=1S/C4H9NO.C3H7NO/c1-3(2)4(5)6;1-4(2)3-5/h3H,1-2H3,(H2,5,6);3H,1-2H3
InChIKeyGDSGOURSWXWMMF-UHFFFAOYSA-N
MW160.22 g/mol
LogP-0.17
Rot. Bonds2

About N,N-dimethylformamide;2-methylpropanamide

N,N-dimethylformamide;2-methylpropanamide (PubChem CID 87581099) has the molecular formula C7H16N2O2 and a molecular weight of 160.22 g/mol. Its IUPAC name is N,N-dimethylformamide;2-methylpropanamide.

Molecular Properties

Compound NameN,N-dimethylformamide;2-methylpropanamide
PubChem CID87581099
Molecular FormulaC7H16N2O2
Molecular Weight160.22 g/mol
Exact Mass160.12
IUPAC NameN,N-dimethylformamide;2-methylpropanamide
SMILESCC(C)C(N)=O.CN(C)C=O
InChIInChI=1S/C4H9NO.C3H7NO/c1-3(2)4(5)6;1-4(2)3-5/h3H,1-2H3,(H2,5,6);3H,1-2H3
InChIKeyGDSGOURSWXWMMF-UHFFFAOYSA-N
XLogP-0.17
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.22
LogP ≤ 5-0.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N,N-dimethylacetamide;2-methylpropanamide
CID 19931526
N-methylacetamide;2-methylpropanamide
CID 22023245
acetamide;N,N-dimethylformamide
CID 55290862
N-methylformamide;N,N,2-trimethylpropanamide
CID 88170797
N,N-diethylformamide;2-methylpropanamide
CID 88433929
N,N-dimethylformamide;2-ethylbutanamide
CID 118917996
N,N-dimethylacetamide;propanamide
CID 158556722
butanamide;N,N-dimethylformamide
CID 160142932
N,N-dimethylformamide;N-methylpropanamide
CID 160764246
N,N-dimethylformamide;propanamide
CID 160888021
azane;N,N-dimethylacetamide;2-methylpropanamide
CID 177723855

Frequently Asked Questions

What is the IUPAC name of N,N-dimethylformamide;2-methylpropanamide?
The IUPAC name of N,N-dimethylformamide;2-methylpropanamide (CID 87581099) is N,N-dimethylformamide;2-methylpropanamide.
What is the SMILES notation for N,N-dimethylformamide;2-methylpropanamide?
The canonical SMILES for N,N-dimethylformamide;2-methylpropanamide is CC(C)C(N)=O.CN(C)C=O.
What is the InChIKey of N,N-dimethylformamide;2-methylpropanamide?
The InChIKey is GDSGOURSWXWMMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9NO.C3H7NO/c1-3(2)4(5)6;1-4(2)3-5/h3H,1-2H3,(H2,5,6);3H,1-2H3.
What are the key properties of N,N-dimethylformamide;2-methylpropanamide?
N,N-dimethylformamide;2-methylpropanamide has a molecular weight of 160.22 g/mol, XLogP of -0.17, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethylformamide;2-methylpropanamide is sourced from PubChem (CID 87581099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).