N-methyl-2-(propylamino)acetamide

C6H14N2O — CID 28586328

IUPACN-methyl-2-(propylamino)acetamide
SMILESCCCNCC(=O)NC
InChIInChI=1S/C6H14N2O/c1-3-4-8-5-6(9)7-2/h8H,3-5H2,1-2H3,(H,7,9)
InChIKeyJGVUSZBDWHKJQV-UHFFFAOYSA-N
MW130.19 g/mol
LogP-0.27
Rot. Bonds4

About N-methyl-2-(propylamino)acetamide

N-methyl-2-(propylamino)acetamide (PubChem CID 28586328) has the molecular formula C6H14N2O and a molecular weight of 130.19 g/mol. Its IUPAC name is N-methyl-2-(propylamino)acetamide.

Molecular Properties

Compound NameN-methyl-2-(propylamino)acetamide
PubChem CID28586328
Molecular FormulaC6H14N2O
Molecular Weight130.19 g/mol
Exact Mass130.11
IUPAC NameN-methyl-2-(propylamino)acetamide
SMILESCCCNCC(=O)NC
InChIInChI=1S/C6H14N2O/c1-3-4-8-5-6(9)7-2/h8H,3-5H2,1-2H3,(H,7,9)
InChIKeyJGVUSZBDWHKJQV-UHFFFAOYSA-N
XLogP-0.27
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.19
LogP ≤ 5-0.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-methyl-4-[[2-(methylamino)-2-oxoethyl]amino]butanamide
CID 63892682
N-methyl-N-[2-(methylamino)-2-oxoethyl]-2-(propylamino)acetamide
CID 60672011
N-propan-2-yl-2-(propylamino)acetamide
CID 28586282
2-(3-ethylheptylamino)-N-methylacetamide
CID 115885339
2-(propylamino)acetamide
CID 15839438
N-[(2-methylpropan-2-yl)oxy]-2-(propylamino)acetamide
CID 82723789
2-[2-[[2-[[2-(methylamino)-2-oxoethyl]amino]-2-oxoethyl]amino]ethylamino]acetic acid
CID 89108194
N-[2-(methylsulfamoyl)ethyl]-2-(propylamino)acetamide
CID 106336906
N-prop-2-enyl-2-(propylamino)acetamide
CID 54819030
N-methyl-2-[2-[(2-methylpropan-2-yl)oxy]ethylamino]acetamide
CID 112588757
N-methyl-2-(methylamino)acetamide
CID 2463138
2-(2-tert-butylsulfonylethylamino)-N-methylacetamide
CID 106723192

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(propylamino)acetamide?
The IUPAC name of N-methyl-2-(propylamino)acetamide (CID 28586328) is N-methyl-2-(propylamino)acetamide.
What is the SMILES notation for N-methyl-2-(propylamino)acetamide?
The canonical SMILES for N-methyl-2-(propylamino)acetamide is CCCNCC(=O)NC.
What is the InChIKey of N-methyl-2-(propylamino)acetamide?
The InChIKey is JGVUSZBDWHKJQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O/c1-3-4-8-5-6(9)7-2/h8H,3-5H2,1-2H3,(H,7,9).
What are the key properties of N-methyl-2-(propylamino)acetamide?
N-methyl-2-(propylamino)acetamide has a molecular weight of 130.19 g/mol, XLogP of -0.27, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(propylamino)acetamide is sourced from PubChem (CID 28586328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).