1-cyclobutyl-N-cyclopropyl-4-methylimidazol-2-amine

C11H17N3 — CID 106571443

IUPAC1-cyclobutyl-N-cyclopropyl-4-methylimidazol-2-amine
SMILESCc1cn(C2CCC2)c(NC2CC2)n1
InChIInChI=1S/C11H17N3/c1-8-7-14(10-3-2-4-10)11(12-8)13-9-5-6-9/h7,9-10H,2-6H2,1H3,(H,12,13)
InChIKeyMTDAKGBIURIBLD-UHFFFAOYSA-N
MW191.28 g/mol
LogP2.49
Rot. Bonds3

About 1-cyclobutyl-N-cyclopropyl-4-methylimidazol-2-amine

1-cyclobutyl-N-cyclopropyl-4-methylimidazol-2-amine (PubChem CID 106571443) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is 1-cyclobutyl-N-cyclopropyl-4-methylimidazol-2-amine.

Molecular Properties

Compound Name1-cyclobutyl-N-cyclopropyl-4-methylimidazol-2-amine
PubChem CID106571443
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC Name1-cyclobutyl-N-cyclopropyl-4-methylimidazol-2-amine
SMILESCc1cn(C2CCC2)c(NC2CC2)n1
InChIInChI=1S/C11H17N3/c1-8-7-14(10-3-2-4-10)11(12-8)13-9-5-6-9/h7,9-10H,2-6H2,1H3,(H,12,13)
InChIKeyMTDAKGBIURIBLD-UHFFFAOYSA-N
XLogP2.49
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyclobutyl-N-cyclopropyl-4-methylimidazol-2-amine?
The IUPAC name of 1-cyclobutyl-N-cyclopropyl-4-methylimidazol-2-amine (CID 106571443) is 1-cyclobutyl-N-cyclopropyl-4-methylimidazol-2-amine.
What is the SMILES notation for 1-cyclobutyl-N-cyclopropyl-4-methylimidazol-2-amine?
The canonical SMILES for 1-cyclobutyl-N-cyclopropyl-4-methylimidazol-2-amine is Cc1cn(C2CCC2)c(NC2CC2)n1.
What is the InChIKey of 1-cyclobutyl-N-cyclopropyl-4-methylimidazol-2-amine?
The InChIKey is MTDAKGBIURIBLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3/c1-8-7-14(10-3-2-4-10)11(12-8)13-9-5-6-9/h7,9-10H,2-6H2,1H3,(H,12,13).
What are the key properties of 1-cyclobutyl-N-cyclopropyl-4-methylimidazol-2-amine?
1-cyclobutyl-N-cyclopropyl-4-methylimidazol-2-amine has a molecular weight of 191.28 g/mol, XLogP of 2.49, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutyl-N-cyclopropyl-4-methylimidazol-2-amine is sourced from PubChem (CID 106571443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).