N,N,3-trimethyl-2-(methylamino)imidazole-4-carboxamide

C8H14N4O — CID 156736982

IUPACN,N,3-trimethyl-2-(methylamino)imidazole-4-carboxamide
SMILESCNc1ncc(C(=O)N(C)C)n1C
InChIInChI=1S/C8H14N4O/c1-9-8-10-5-6(12(8)4)7(13)11(2)3/h5H,1-4H3,(H,9,10)
InChIKeyDWJFTZIYJGOFEW-UHFFFAOYSA-N
MW182.23 g/mol
LogP0.16
Rot. Bonds2

About N,N,3-trimethyl-2-(methylamino)imidazole-4-carboxamide

N,N,3-trimethyl-2-(methylamino)imidazole-4-carboxamide (PubChem CID 156736982) has the molecular formula C8H14N4O and a molecular weight of 182.23 g/mol. Its IUPAC name is N,N,3-trimethyl-2-(methylamino)imidazole-4-carboxamide.

Molecular Properties

Compound NameN,N,3-trimethyl-2-(methylamino)imidazole-4-carboxamide
PubChem CID156736982
Molecular FormulaC8H14N4O
Molecular Weight182.23 g/mol
Exact Mass182.12
IUPAC NameN,N,3-trimethyl-2-(methylamino)imidazole-4-carboxamide
SMILESCNc1ncc(C(=O)N(C)C)n1C
InChIInChI=1S/C8H14N4O/c1-9-8-10-5-6(12(8)4)7(13)11(2)3/h5H,1-4H3,(H,9,10)
InChIKeyDWJFTZIYJGOFEW-UHFFFAOYSA-N
XLogP0.16
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.23
LogP ≤ 50.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(methylamino)-3-propan-2-ylimidazole-4-carboxylic acid
CID 84659028
N,N,1-trimethyl-1,2,4-triazole-3-carboxamide
CID 59693974
5-chloro-N,N-dimethyl-6-(methylamino)pyridine-3-carboxamide
CID 62170738
1,1-dimethyl-3-(1-methylimidazol-2-yl)urea
CID 110470347
3-methyl-2-(methylaminomethyl)imidazole-4-carboxylic acid
CID 117188318
N,N-dimethyl-12-oxo-3,6,9-triazatricyclo[7.4.0.02,6]trideca-1(13),2,4,10-tetraene-5-carboxamide
CID 175129456
N,N,5,6-tetramethylpyridine-3-carboxamide
CID 178150926
8-tert-butyl-6-fluoro-N,N-dimethylimidazo[1,2-a]pyridine-3-carboxamide
CID 166563348
N,N-dimethyl-8-(1,3-oxazol-5-yl)-6-(trifluoromethyl)imidazo[1,2-a]pyridine-3-carboxamide
CID 118379021
1-[5-chloro-3-(methylamino)-2-pyridinyl]-N,N-dimethylpyrazole-4-carboxamide
CID 143780479
1-tert-butyl-N,N-dimethylimidazole-2-carboxamide
CID 58336927
N,N-dimethyl-1-propan-2-ylimidazole-4-carboxamide
CID 58415709

Frequently Asked Questions

What is the IUPAC name of N,N,3-trimethyl-2-(methylamino)imidazole-4-carboxamide?
The IUPAC name of N,N,3-trimethyl-2-(methylamino)imidazole-4-carboxamide (CID 156736982) is N,N,3-trimethyl-2-(methylamino)imidazole-4-carboxamide.
What is the SMILES notation for N,N,3-trimethyl-2-(methylamino)imidazole-4-carboxamide?
The canonical SMILES for N,N,3-trimethyl-2-(methylamino)imidazole-4-carboxamide is CNc1ncc(C(=O)N(C)C)n1C.
What is the InChIKey of N,N,3-trimethyl-2-(methylamino)imidazole-4-carboxamide?
The InChIKey is DWJFTZIYJGOFEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4O/c1-9-8-10-5-6(12(8)4)7(13)11(2)3/h5H,1-4H3,(H,9,10).
What are the key properties of N,N,3-trimethyl-2-(methylamino)imidazole-4-carboxamide?
N,N,3-trimethyl-2-(methylamino)imidazole-4-carboxamide has a molecular weight of 182.23 g/mol, XLogP of 0.16, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,3-trimethyl-2-(methylamino)imidazole-4-carboxamide is sourced from PubChem (CID 156736982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).