N,1,3-trimethyl-2H-imidazole-2-carboxamide

C7H13N3O — CID 138514062

IUPACN,1,3-trimethyl-2H-imidazole-2-carboxamide
SMILESCNC(=O)C1N(C)C=CN1C
InChIInChI=1S/C7H13N3O/c1-8-6(11)7-9(2)4-5-10(7)3/h4-5,7H,1-3H3,(H,8,11)
InChIKeyRLPFIQZSEVFFLU-UHFFFAOYSA-N
MW155.20 g/mol
LogP-0.59
Rot. Bonds1

About N,1,3-trimethyl-2H-imidazole-2-carboxamide

N,1,3-trimethyl-2H-imidazole-2-carboxamide (PubChem CID 138514062) has the molecular formula C7H13N3O and a molecular weight of 155.20 g/mol. Its IUPAC name is N,1,3-trimethyl-2H-imidazole-2-carboxamide.

Molecular Properties

Compound NameN,1,3-trimethyl-2H-imidazole-2-carboxamide
PubChem CID138514062
Molecular FormulaC7H13N3O
Molecular Weight155.20 g/mol
Exact Mass155.11
IUPAC NameN,1,3-trimethyl-2H-imidazole-2-carboxamide
SMILESCNC(=O)C1N(C)C=CN1C
InChIInChI=1S/C7H13N3O/c1-8-6(11)7-9(2)4-5-10(7)3/h4-5,7H,1-3H3,(H,8,11)
InChIKeyRLPFIQZSEVFFLU-UHFFFAOYSA-N
XLogP-0.59
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 5-0.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,1,3-trimethyl-2H-imidazole-2-carboxamide?
The IUPAC name of N,1,3-trimethyl-2H-imidazole-2-carboxamide (CID 138514062) is N,1,3-trimethyl-2H-imidazole-2-carboxamide.
What is the SMILES notation for N,1,3-trimethyl-2H-imidazole-2-carboxamide?
The canonical SMILES for N,1,3-trimethyl-2H-imidazole-2-carboxamide is CNC(=O)C1N(C)C=CN1C.
What is the InChIKey of N,1,3-trimethyl-2H-imidazole-2-carboxamide?
The InChIKey is RLPFIQZSEVFFLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N3O/c1-8-6(11)7-9(2)4-5-10(7)3/h4-5,7H,1-3H3,(H,8,11).
What are the key properties of N,1,3-trimethyl-2H-imidazole-2-carboxamide?
N,1,3-trimethyl-2H-imidazole-2-carboxamide has a molecular weight of 155.20 g/mol, XLogP of -0.59, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,1,3-trimethyl-2H-imidazole-2-carboxamide is sourced from PubChem (CID 138514062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).