N,N-dimethylformamide;propanamide

C6H14N2O2 — CID 160888021

IUPACN,N-dimethylformamide;propanamide
SMILESCCC(N)=O.CN(C)C=O
InChIInChI=1S/2C3H7NO/c1-4(2)3-5;1-2-3(4)5/h3H,1-2H3;2H2,1H3,(H2,4,5)
InChIKeySNWXMMVKXBCLTK-UHFFFAOYSA-N
MW146.19 g/mol
LogP-0.41
Rot. Bonds2

About N,N-dimethylformamide;propanamide

N,N-dimethylformamide;propanamide (PubChem CID 160888021) has the molecular formula C6H14N2O2 and a molecular weight of 146.19 g/mol. Its IUPAC name is N,N-dimethylformamide;propanamide.

Molecular Properties

Compound NameN,N-dimethylformamide;propanamide
PubChem CID160888021
Molecular FormulaC6H14N2O2
Molecular Weight146.19 g/mol
Exact Mass146.11
IUPAC NameN,N-dimethylformamide;propanamide
SMILESCCC(N)=O.CN(C)C=O
InChIInChI=1S/2C3H7NO/c1-4(2)3-5;1-2-3(4)5/h3H,1-2H3;2H2,1H3,(H2,4,5)
InChIKeySNWXMMVKXBCLTK-UHFFFAOYSA-N
XLogP-0.41
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 5-0.41
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-methylacetamide;N-methylformamide
CID 21715506
N,N-dimethylformamide;N-methylacetamide
CID 22057705
acetamide;N,N-dimethylformamide
CID 55290862
N,N-dimethylformamide;2-methylpropanamide
CID 87581099
formamide;N-methylacetamide
CID 87879452
N,N-dimethylacetamide;formamide
CID 88505567
acetamide;N-methylformamide
CID 88762249
N,N-dimethylpropanamide;propanamide
CID 91411396
acetamide;N,N-dimethylacetamide
CID 140368582
formamide;methane;N-methylacetamide
CID 157606304
N,N-dimethylacetamide;propanamide
CID 158556722
N,N-dimethylacetamide;N-methylformamide
CID 159272937

Frequently Asked Questions

What is the IUPAC name of N,N-dimethylformamide;propanamide?
The IUPAC name of N,N-dimethylformamide;propanamide (CID 160888021) is N,N-dimethylformamide;propanamide.
What is the SMILES notation for N,N-dimethylformamide;propanamide?
The canonical SMILES for N,N-dimethylformamide;propanamide is CCC(N)=O.CN(C)C=O.
What is the InChIKey of N,N-dimethylformamide;propanamide?
The InChIKey is SNWXMMVKXBCLTK-UHFFFAOYSA-N. The full InChI is InChI=1S/2C3H7NO/c1-4(2)3-5;1-2-3(4)5/h3H,1-2H3;2H2,1H3,(H2,4,5).
What are the key properties of N,N-dimethylformamide;propanamide?
N,N-dimethylformamide;propanamide has a molecular weight of 146.19 g/mol, XLogP of -0.41, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethylformamide;propanamide is sourced from PubChem (CID 160888021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).