3-(methylamino)propanamide

C4H10N2O — CID 22182162

IUPAC3-(methylamino)propanamide
SMILESCNCCC(N)=O
InChIInChI=1S/C4H10N2O/c1-6-3-2-4(5)7/h6H,2-3H2,1H3,(H2,5,7)
InChIKeyFFJLSBFLTYYWII-UHFFFAOYSA-N
MW102.14 g/mol
LogP-0.92
Rot. Bonds3

About 3-(methylamino)propanamide

3-(methylamino)propanamide (PubChem CID 22182162) has the molecular formula C4H10N2O and a molecular weight of 102.14 g/mol. Its IUPAC name is 3-(methylamino)propanamide.

Molecular Properties

Compound Name3-(methylamino)propanamide
PubChem CID22182162
Molecular FormulaC4H10N2O
Molecular Weight102.14 g/mol
Exact Mass102.08
IUPAC Name3-(methylamino)propanamide
SMILESCNCCC(N)=O
InChIInChI=1S/C4H10N2O/c1-6-3-2-4(5)7/h6H,2-3H2,1H3,(H2,5,7)
InChIKeyFFJLSBFLTYYWII-UHFFFAOYSA-N
XLogP-0.92
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500102.14
LogP ≤ 5-0.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(methylamino)propanamide?
The IUPAC name of 3-(methylamino)propanamide (CID 22182162) is 3-(methylamino)propanamide.
What is the SMILES notation for 3-(methylamino)propanamide?
The canonical SMILES for 3-(methylamino)propanamide is CNCCC(N)=O.
What is the InChIKey of 3-(methylamino)propanamide?
The InChIKey is FFJLSBFLTYYWII-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10N2O/c1-6-3-2-4(5)7/h6H,2-3H2,1H3,(H2,5,7).
What are the key properties of 3-(methylamino)propanamide?
3-(methylamino)propanamide has a molecular weight of 102.14 g/mol, XLogP of -0.92, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methylamino)propanamide is sourced from PubChem (CID 22182162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).