2,3-dihydro-1H-imidazole-2-carboxamide

C4H7N3O — CID 68859116

IUPAC2,3-dihydro-1H-imidazole-2-carboxamide
SMILESNC(=O)C1NC=CN1
InChIInChI=1S/C4H7N3O/c5-3(8)4-6-1-2-7-4/h1-2,4,6-7H,(H2,5,8)
InChIKeyVJPICGQIRQQNJW-UHFFFAOYSA-N
MW113.12 g/mol
LogP-1.54
Rot. Bonds1

About 2,3-dihydro-1H-imidazole-2-carboxamide

2,3-dihydro-1H-imidazole-2-carboxamide (PubChem CID 68859116) has the molecular formula C4H7N3O and a molecular weight of 113.12 g/mol. Its IUPAC name is 2,3-dihydro-1H-imidazole-2-carboxamide.

Molecular Properties

Compound Name2,3-dihydro-1H-imidazole-2-carboxamide
PubChem CID68859116
Molecular FormulaC4H7N3O
Molecular Weight113.12 g/mol
Exact Mass113.06
IUPAC Name2,3-dihydro-1H-imidazole-2-carboxamide
SMILESNC(=O)C1NC=CN1
InChIInChI=1S/C4H7N3O/c5-3(8)4-6-1-2-7-4/h1-2,4,6-7H,(H2,5,8)
InChIKeyVJPICGQIRQQNJW-UHFFFAOYSA-N
XLogP-1.54
TPSA67.15 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.12
LogP ≤ 5-1.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1H-imidazole-2-carboxamide?
The IUPAC name of 2,3-dihydro-1H-imidazole-2-carboxamide (CID 68859116) is 2,3-dihydro-1H-imidazole-2-carboxamide.
What is the SMILES notation for 2,3-dihydro-1H-imidazole-2-carboxamide?
The canonical SMILES for 2,3-dihydro-1H-imidazole-2-carboxamide is NC(=O)C1NC=CN1.
What is the InChIKey of 2,3-dihydro-1H-imidazole-2-carboxamide?
The InChIKey is VJPICGQIRQQNJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7N3O/c5-3(8)4-6-1-2-7-4/h1-2,4,6-7H,(H2,5,8).
What are the key properties of 2,3-dihydro-1H-imidazole-2-carboxamide?
2,3-dihydro-1H-imidazole-2-carboxamide has a molecular weight of 113.12 g/mol, XLogP of -1.54, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1H-imidazole-2-carboxamide is sourced from PubChem (CID 68859116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).