3-formamido-N,N-dimethylpropanamide

C6H12N2O2 — CID 54477348

IUPAC3-formamido-N,N-dimethylpropanamide
SMILESCN(C)C(=O)CCNC=O
InChIInChI=1S/C6H12N2O2/c1-8(2)6(10)3-4-7-5-9/h5H,3-4H2,1-2H3,(H,7,9)
InChIKeyCTSZJYGMYSNUJL-UHFFFAOYSA-N
MW144.17 g/mol
LogP-0.79
Rot. Bonds4

About 3-formamido-N,N-dimethylpropanamide

3-formamido-N,N-dimethylpropanamide (PubChem CID 54477348) has the molecular formula C6H12N2O2 and a molecular weight of 144.17 g/mol. Its IUPAC name is 3-formamido-N,N-dimethylpropanamide.

Molecular Properties

Compound Name3-formamido-N,N-dimethylpropanamide
PubChem CID54477348
Molecular FormulaC6H12N2O2
Molecular Weight144.17 g/mol
Exact Mass144.09
IUPAC Name3-formamido-N,N-dimethylpropanamide
SMILESCN(C)C(=O)CCNC=O
InChIInChI=1S/C6H12N2O2/c1-8(2)6(10)3-4-7-5-9/h5H,3-4H2,1-2H3,(H,7,9)
InChIKeyCTSZJYGMYSNUJL-UHFFFAOYSA-N
XLogP-0.79
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.17
LogP ≤ 5-0.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-formamido-N,N-dimethylpropanamide?
The IUPAC name of 3-formamido-N,N-dimethylpropanamide (CID 54477348) is 3-formamido-N,N-dimethylpropanamide.
What is the SMILES notation for 3-formamido-N,N-dimethylpropanamide?
The canonical SMILES for 3-formamido-N,N-dimethylpropanamide is CN(C)C(=O)CCNC=O.
What is the InChIKey of 3-formamido-N,N-dimethylpropanamide?
The InChIKey is CTSZJYGMYSNUJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2O2/c1-8(2)6(10)3-4-7-5-9/h5H,3-4H2,1-2H3,(H,7,9).
What are the key properties of 3-formamido-N,N-dimethylpropanamide?
3-formamido-N,N-dimethylpropanamide has a molecular weight of 144.17 g/mol, XLogP of -0.79, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-formamido-N,N-dimethylpropanamide is sourced from PubChem (CID 54477348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).