N-methyl-N-[2-(methylamino)-2-oxoethyl]-2-(propylamino)acetamide

C9H19N3O2 — CID 60672011

IUPACN-methyl-N-[2-(methylamino)-2-oxoethyl]-2-(propylamino)acetamide
SMILESCCCNCC(=O)N(C)CC(=O)NC
InChIInChI=1S/C9H19N3O2/c1-4-5-11-6-9(14)12(3)7-8(13)10-2/h11H,4-7H2,1-3H3,(H,10,13)
InChIKeyUIRVFEUUENGNCG-UHFFFAOYSA-N
MW201.27 g/mol
LogP-0.81
Rot. Bonds6

About N-methyl-N-[2-(methylamino)-2-oxoethyl]-2-(propylamino)acetamide

N-methyl-N-[2-(methylamino)-2-oxoethyl]-2-(propylamino)acetamide (PubChem CID 60672011) has the molecular formula C9H19N3O2 and a molecular weight of 201.27 g/mol. Its IUPAC name is N-methyl-N-[2-(methylamino)-2-oxoethyl]-2-(propylamino)acetamide.

Molecular Properties

Compound NameN-methyl-N-[2-(methylamino)-2-oxoethyl]-2-(propylamino)acetamide
PubChem CID60672011
Molecular FormulaC9H19N3O2
Molecular Weight201.27 g/mol
Exact Mass201.15
IUPAC NameN-methyl-N-[2-(methylamino)-2-oxoethyl]-2-(propylamino)acetamide
SMILESCCCNCC(=O)N(C)CC(=O)NC
InChIInChI=1S/C9H19N3O2/c1-4-5-11-6-9(14)12(3)7-8(13)10-2/h11H,4-7H2,1-3H3,(H,10,13)
InChIKeyUIRVFEUUENGNCG-UHFFFAOYSA-N
XLogP-0.81
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 5-0.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(ethylamino)-2-oxoethyl]-N-methyl-2-(propylamino)acetamide
CID 55207779
N-methyl-2-(propylamino)acetamide
CID 28586328
3-(ethylamino)-N-methyl-N-[2-(methylamino)-2-oxoethyl]propanamide
CID 62833977
N-methyl-N-[2-oxo-2-(propylamino)ethyl]-2-(2,2,2-trifluoroethylamino)acetamide
CID 78914805
N,N-diethyl-2-(propylamino)acetamide
CID 15103931
ethyl N-methyl-N-[2-(methylamino)-2-oxoethyl]carbamate
CID 60652010
N-methyl-N-[2-(methylamino)-2-oxoethyl]-3-sulfanylpropanamide
CID 107022688
N,3,3-trimethyl-N-[2-(methylamino)-2-oxoethyl]butanamide
CID 130272316
ethyl 4-[methyl-[2-(methylamino)-2-oxoethyl]amino]-4-oxobutanoate
CID 60659458
3-amino-N-methyl-N-[2-[methyl-[2-[methyl-[2-[methyl-[2-[methyl-[2-[methyl-[2-[methyl-[2-[methyl-[2-[methyl-[2-[methyl-[2-(methylamino)-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]propanamide
CID 165148153
2-(3-ethyl-2,4,5-trioxoimidazolidin-1-yl)-N-methyl-N-[2-(methylamino)-2-oxoethyl]acetamide
CID 9374526
2-[[2-(dimethylamino)-2-oxoethyl]amino]-N-methylacetamide
CID 43214721

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[2-(methylamino)-2-oxoethyl]-2-(propylamino)acetamide?
The IUPAC name of N-methyl-N-[2-(methylamino)-2-oxoethyl]-2-(propylamino)acetamide (CID 60672011) is N-methyl-N-[2-(methylamino)-2-oxoethyl]-2-(propylamino)acetamide.
What is the SMILES notation for N-methyl-N-[2-(methylamino)-2-oxoethyl]-2-(propylamino)acetamide?
The canonical SMILES for N-methyl-N-[2-(methylamino)-2-oxoethyl]-2-(propylamino)acetamide is CCCNCC(=O)N(C)CC(=O)NC.
What is the InChIKey of N-methyl-N-[2-(methylamino)-2-oxoethyl]-2-(propylamino)acetamide?
The InChIKey is UIRVFEUUENGNCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O2/c1-4-5-11-6-9(14)12(3)7-8(13)10-2/h11H,4-7H2,1-3H3,(H,10,13).
What are the key properties of N-methyl-N-[2-(methylamino)-2-oxoethyl]-2-(propylamino)acetamide?
N-methyl-N-[2-(methylamino)-2-oxoethyl]-2-(propylamino)acetamide has a molecular weight of 201.27 g/mol, XLogP of -0.81, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[2-(methylamino)-2-oxoethyl]-2-(propylamino)acetamide is sourced from PubChem (CID 60672011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).