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

C8H17N3O2 — CID 60661823

IUPAC2-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]acetamide
SMILESCC(C)NC(=O)CN(C)C(=O)CN
InChIInChI=1S/C8H17N3O2/c1-6(2)10-7(12)5-11(3)8(13)4-9/h6H,4-5,9H2,1-3H3,(H,10,12)
InChIKeyCVIXLHVEXKXTDM-UHFFFAOYSA-N
MW187.24 g/mol
LogP-1.07
Rot. Bonds4

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

2-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]acetamide (PubChem CID 60661823) has the molecular formula C8H17N3O2 and a molecular weight of 187.24 g/mol. Its IUPAC name is 2-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]acetamide.

Molecular Properties

Compound Name2-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]acetamide
PubChem CID60661823
Molecular FormulaC8H17N3O2
Molecular Weight187.24 g/mol
Exact Mass187.13
IUPAC Name2-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]acetamide
SMILESCC(C)NC(=O)CN(C)C(=O)CN
InChIInChI=1S/C8H17N3O2/c1-6(2)10-7(12)5-11(3)8(13)4-9/h6H,4-5,9H2,1-3H3,(H,10,12)
InChIKeyCVIXLHVEXKXTDM-UHFFFAOYSA-N
XLogP-1.07
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.24
LogP ≤ 5-1.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]butanamide;hydrochloride
CID 119272108
3-amino-N,3-dimethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]butanamide
CID 64685273
2-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]propanamide
CID 60937489
2-[1-(aminomethyl)cyclobutyl]-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]acetamide
CID 81171717
5-hydroxy-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pentanamide
CID 79198624
2-[methyl(methylcarbamoyl)amino]-N-propan-2-ylacetamide
CID 115575214
ethane;2-[methyl-[2-[methyl(propyl)amino]acetyl]amino]-N-propan-2-ylacetamide
CID 142388460
N-(2-aminoethyl)-N'-methyl-N'-[2-oxo-2-(propan-2-ylamino)ethyl]oxamide
CID 55000373
(2R)-2-amino-N,3,3-trimethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]butanamide
CID 113353361
(2S)-2-amino-N,4-dimethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pentanamide
CID 61165022
(2R)-2-[[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]carbamoyl]amino]propanoic acid
CID 78973916
2-bromo-N,2-dimethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]propanamide
CID 114328087

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]acetamide?
The IUPAC name of 2-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]acetamide (CID 60661823) is 2-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]acetamide.
What is the SMILES notation for 2-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]acetamide?
The canonical SMILES for 2-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]acetamide is CC(C)NC(=O)CN(C)C(=O)CN.
What is the InChIKey of 2-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]acetamide?
The InChIKey is CVIXLHVEXKXTDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N3O2/c1-6(2)10-7(12)5-11(3)8(13)4-9/h6H,4-5,9H2,1-3H3,(H,10,12).
What are the key properties of 2-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]acetamide?
2-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]acetamide has a molecular weight of 187.24 g/mol, XLogP of -1.07, 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]acetamide is sourced from PubChem (CID 60661823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).