2-cyclobutyl-N-(1H-imidazol-2-yl)acetamide

C9H13N3O — CID 103710639

IUPAC2-cyclobutyl-N-(1H-imidazol-2-yl)acetamide
SMILESO=C(CC1CCC1)Nc1ncc[nH]1
InChIInChI=1S/C9H13N3O/c13-8(6-7-2-1-3-7)12-9-10-4-5-11-9/h4-5,7H,1-3,6H2,(H2,10,11,12,13)
InChIKeyZCIABERXOPCBSG-UHFFFAOYSA-N
MW179.22 g/mol
LogP1.54
Rot. Bonds3

About 2-cyclobutyl-N-(1H-imidazol-2-yl)acetamide

2-cyclobutyl-N-(1H-imidazol-2-yl)acetamide (PubChem CID 103710639) has the molecular formula C9H13N3O and a molecular weight of 179.22 g/mol. Its IUPAC name is 2-cyclobutyl-N-(1H-imidazol-2-yl)acetamide.

Molecular Properties

Compound Name2-cyclobutyl-N-(1H-imidazol-2-yl)acetamide
PubChem CID103710639
Molecular FormulaC9H13N3O
Molecular Weight179.22 g/mol
Exact Mass179.11
IUPAC Name2-cyclobutyl-N-(1H-imidazol-2-yl)acetamide
SMILESO=C(CC1CCC1)Nc1ncc[nH]1
InChIInChI=1S/C9H13N3O/c13-8(6-7-2-1-3-7)12-9-10-4-5-11-9/h4-5,7H,1-3,6H2,(H2,10,11,12,13)
InChIKeyZCIABERXOPCBSG-UHFFFAOYSA-N
XLogP1.54
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.22
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclobutyl-N-(1H-imidazol-2-yl)acetamide?
The IUPAC name of 2-cyclobutyl-N-(1H-imidazol-2-yl)acetamide (CID 103710639) is 2-cyclobutyl-N-(1H-imidazol-2-yl)acetamide.
What is the SMILES notation for 2-cyclobutyl-N-(1H-imidazol-2-yl)acetamide?
The canonical SMILES for 2-cyclobutyl-N-(1H-imidazol-2-yl)acetamide is O=C(CC1CCC1)Nc1ncc[nH]1.
What is the InChIKey of 2-cyclobutyl-N-(1H-imidazol-2-yl)acetamide?
The InChIKey is ZCIABERXOPCBSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O/c13-8(6-7-2-1-3-7)12-9-10-4-5-11-9/h4-5,7H,1-3,6H2,(H2,10,11,12,13).
What are the key properties of 2-cyclobutyl-N-(1H-imidazol-2-yl)acetamide?
2-cyclobutyl-N-(1H-imidazol-2-yl)acetamide has a molecular weight of 179.22 g/mol, XLogP of 1.54, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclobutyl-N-(1H-imidazol-2-yl)acetamide is sourced from PubChem (CID 103710639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).