2-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]propanamide

C9H19N3O2 — CID 60937489

IUPAC2-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]propanamide
SMILESCC(C)NC(=O)CN(C)C(=O)C(C)N
InChIInChI=1S/C9H19N3O2/c1-6(2)11-8(13)5-12(4)9(14)7(3)10/h6-7H,5,10H2,1-4H3,(H,11,13)
InChIKeyHCXLGWCDOKTJIJ-UHFFFAOYSA-N
MW201.27 g/mol
LogP-0.68
Rot. Bonds4

About 2-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]propanamide

2-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]propanamide (PubChem CID 60937489) has the molecular formula C9H19N3O2 and a molecular weight of 201.27 g/mol. Its IUPAC name is 2-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]propanamide.

Molecular Properties

Compound Name2-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]propanamide
PubChem CID60937489
Molecular FormulaC9H19N3O2
Molecular Weight201.27 g/mol
Exact Mass201.15
IUPAC Name2-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]propanamide
SMILESCC(C)NC(=O)CN(C)C(=O)C(C)N
InChIInChI=1S/C9H19N3O2/c1-6(2)11-8(13)5-12(4)9(14)7(3)10/h6-7H,5,10H2,1-4H3,(H,11,13)
InChIKeyHCXLGWCDOKTJIJ-UHFFFAOYSA-N
XLogP-0.68
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 5-0.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-methyl-N-[2-(methylamino)-2-oxoethyl]propanamide
CID 43375282
(2S)-2-amino-N,4-dimethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pentanamide
CID 61165022
(2R)-2-amino-N,3,3-trimethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]butanamide
CID 113353361
2-amino-3-methoxy-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]propanamide
CID 81082656
2-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]acetamide
CID 60661823
(2R)-2-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylpropanamide
CID 78972028
2-[methyl(methylcarbamoyl)amino]-N-propan-2-ylacetamide
CID 115575214
(2R)-2-[[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]carbamoyl]amino]propanoic acid
CID 78973916
2-[[(2R)-2-aminopropanoyl]-methylamino]acetic acid;hydrochloride
CID 88764935
(2S)-2-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]-3-phenylpropanamide;hydrochloride
CID 119272094
(2R)-2-amino-N-methyl-N-(2-methylprop-2-enyl)propanamide
CID 104868591
3-amino-N,3-dimethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]butanamide
CID 64685273

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]propanamide?
The IUPAC name of 2-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]propanamide (CID 60937489) is 2-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]propanamide.
What is the SMILES notation for 2-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]propanamide?
The canonical SMILES for 2-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]propanamide is CC(C)NC(=O)CN(C)C(=O)C(C)N.
What is the InChIKey of 2-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]propanamide?
The InChIKey is HCXLGWCDOKTJIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O2/c1-6(2)11-8(13)5-12(4)9(14)7(3)10/h6-7H,5,10H2,1-4H3,(H,11,13).
What are the key properties of 2-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]propanamide?
2-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]propanamide has a molecular weight of 201.27 g/mol, XLogP of -0.68, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]propanamide is sourced from PubChem (CID 60937489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).