N,2,2-trimethyl-3-(2-oxo-1H-imidazol-3-yl)propanamide

C9H15N3O2 — CID 106276831

IUPACN,2,2-trimethyl-3-(2-oxo-1H-imidazol-3-yl)propanamide
SMILESCNC(=O)C(C)(C)Cn1cc[nH]c1=O
InChIInChI=1S/C9H15N3O2/c1-9(2,7(13)10-3)6-12-5-4-11-8(12)14/h4-5H,6H2,1-3H3,(H,10,13)(H,11,14)
InChIKeyQMZQFIDMOBGZNJ-UHFFFAOYSA-N
MW197.24 g/mol
LogP-0.05
Rot. Bonds3

About N,2,2-trimethyl-3-(2-oxo-1H-imidazol-3-yl)propanamide

N,2,2-trimethyl-3-(2-oxo-1H-imidazol-3-yl)propanamide (PubChem CID 106276831) has the molecular formula C9H15N3O2 and a molecular weight of 197.24 g/mol. Its IUPAC name is N,2,2-trimethyl-3-(2-oxo-1H-imidazol-3-yl)propanamide.

Molecular Properties

Compound NameN,2,2-trimethyl-3-(2-oxo-1H-imidazol-3-yl)propanamide
PubChem CID106276831
Molecular FormulaC9H15N3O2
Molecular Weight197.24 g/mol
Exact Mass197.12
IUPAC NameN,2,2-trimethyl-3-(2-oxo-1H-imidazol-3-yl)propanamide
SMILESCNC(=O)C(C)(C)Cn1cc[nH]c1=O
InChIInChI=1S/C9H15N3O2/c1-9(2,7(13)10-3)6-12-5-4-11-8(12)14/h4-5H,6H2,1-3H3,(H,10,13)(H,11,14)
InChIKeyQMZQFIDMOBGZNJ-UHFFFAOYSA-N
XLogP-0.05
TPSA66.89 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.24
LogP ≤ 5-0.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,2,2-trimethyl-3-(2-oxo-1H-imidazol-3-yl)propanamide?
The IUPAC name of N,2,2-trimethyl-3-(2-oxo-1H-imidazol-3-yl)propanamide (CID 106276831) is N,2,2-trimethyl-3-(2-oxo-1H-imidazol-3-yl)propanamide.
What is the SMILES notation for N,2,2-trimethyl-3-(2-oxo-1H-imidazol-3-yl)propanamide?
The canonical SMILES for N,2,2-trimethyl-3-(2-oxo-1H-imidazol-3-yl)propanamide is CNC(=O)C(C)(C)Cn1cc[nH]c1=O.
What is the InChIKey of N,2,2-trimethyl-3-(2-oxo-1H-imidazol-3-yl)propanamide?
The InChIKey is QMZQFIDMOBGZNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O2/c1-9(2,7(13)10-3)6-12-5-4-11-8(12)14/h4-5H,6H2,1-3H3,(H,10,13)(H,11,14).
What are the key properties of N,2,2-trimethyl-3-(2-oxo-1H-imidazol-3-yl)propanamide?
N,2,2-trimethyl-3-(2-oxo-1H-imidazol-3-yl)propanamide has a molecular weight of 197.24 g/mol, XLogP of -0.05, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,2-trimethyl-3-(2-oxo-1H-imidazol-3-yl)propanamide is sourced from PubChem (CID 106276831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).