N,N-dimethylpropanamide;propanamide

C8H18N2O2 — CID 91411396

IUPACN,N-dimethylpropanamide;propanamide
SMILESCCC(=O)N(C)C.CCC(N)=O
InChIInChI=1S/C5H11NO.C3H7NO/c1-4-5(7)6(2)3;1-2-3(4)5/h4H2,1-3H3;2H2,1H3,(H2,4,5)
InChIKeyROJXXRIGJMCWQJ-UHFFFAOYSA-N
MW174.24 g/mol
LogP0.37
Rot. Bonds2

About N,N-dimethylpropanamide;propanamide

N,N-dimethylpropanamide;propanamide (PubChem CID 91411396) has the molecular formula C8H18N2O2 and a molecular weight of 174.24 g/mol. Its IUPAC name is N,N-dimethylpropanamide;propanamide.

Molecular Properties

Compound NameN,N-dimethylpropanamide;propanamide
PubChem CID91411396
Molecular FormulaC8H18N2O2
Molecular Weight174.24 g/mol
Exact Mass174.14
IUPAC NameN,N-dimethylpropanamide;propanamide
SMILESCCC(=O)N(C)C.CCC(N)=O
InChIInChI=1S/C5H11NO.C3H7NO/c1-4-5(7)6(2)3;1-2-3(4)5/h4H2,1-3H3;2H2,1H3,(H2,4,5)
InChIKeyROJXXRIGJMCWQJ-UHFFFAOYSA-N
XLogP0.37
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.24
LogP ≤ 50.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 59019173
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CID 87312235
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Frequently Asked Questions

What is the IUPAC name of N,N-dimethylpropanamide;propanamide?
The IUPAC name of N,N-dimethylpropanamide;propanamide (CID 91411396) is N,N-dimethylpropanamide;propanamide.
What is the SMILES notation for N,N-dimethylpropanamide;propanamide?
The canonical SMILES for N,N-dimethylpropanamide;propanamide is CCC(=O)N(C)C.CCC(N)=O.
What is the InChIKey of N,N-dimethylpropanamide;propanamide?
The InChIKey is ROJXXRIGJMCWQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NO.C3H7NO/c1-4-5(7)6(2)3;1-2-3(4)5/h4H2,1-3H3;2H2,1H3,(H2,4,5).
What are the key properties of N,N-dimethylpropanamide;propanamide?
N,N-dimethylpropanamide;propanamide has a molecular weight of 174.24 g/mol, XLogP of 0.37, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethylpropanamide;propanamide is sourced from PubChem (CID 91411396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).