1-ethyl-5-(2-methylcyclopropyl)imidazol-2-amine

C9H15N3 — CID 130698488

IUPAC1-ethyl-5-(2-methylcyclopropyl)imidazol-2-amine
SMILESCCn1c(C2CC2C)cnc1N
InChIInChI=1S/C9H15N3/c1-3-12-8(5-11-9(12)10)7-4-6(7)2/h5-7H,3-4H2,1-2H3,(H2,10,11)
InChIKeyVLILNXKMAARQQC-UHFFFAOYSA-N
MW165.24 g/mol
LogP1.61
Rot. Bonds2

About 1-ethyl-5-(2-methylcyclopropyl)imidazol-2-amine

1-ethyl-5-(2-methylcyclopropyl)imidazol-2-amine (PubChem CID 130698488) has the molecular formula C9H15N3 and a molecular weight of 165.24 g/mol. Its IUPAC name is 1-ethyl-5-(2-methylcyclopropyl)imidazol-2-amine.

Molecular Properties

Compound Name1-ethyl-5-(2-methylcyclopropyl)imidazol-2-amine
PubChem CID130698488
Molecular FormulaC9H15N3
Molecular Weight165.24 g/mol
Exact Mass165.13
IUPAC Name1-ethyl-5-(2-methylcyclopropyl)imidazol-2-amine
SMILESCCn1c(C2CC2C)cnc1N
InChIInChI=1S/C9H15N3/c1-3-12-8(5-11-9(12)10)7-4-6(7)2/h5-7H,3-4H2,1-2H3,(H2,10,11)
InChIKeyVLILNXKMAARQQC-UHFFFAOYSA-N
XLogP1.61
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-5-(2-methylcyclopropyl)imidazol-2-amine?
The IUPAC name of 1-ethyl-5-(2-methylcyclopropyl)imidazol-2-amine (CID 130698488) is 1-ethyl-5-(2-methylcyclopropyl)imidazol-2-amine.
What is the SMILES notation for 1-ethyl-5-(2-methylcyclopropyl)imidazol-2-amine?
The canonical SMILES for 1-ethyl-5-(2-methylcyclopropyl)imidazol-2-amine is CCn1c(C2CC2C)cnc1N.
What is the InChIKey of 1-ethyl-5-(2-methylcyclopropyl)imidazol-2-amine?
The InChIKey is VLILNXKMAARQQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3/c1-3-12-8(5-11-9(12)10)7-4-6(7)2/h5-7H,3-4H2,1-2H3,(H2,10,11).
What are the key properties of 1-ethyl-5-(2-methylcyclopropyl)imidazol-2-amine?
1-ethyl-5-(2-methylcyclopropyl)imidazol-2-amine has a molecular weight of 165.24 g/mol, XLogP of 1.61, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-5-(2-methylcyclopropyl)imidazol-2-amine is sourced from PubChem (CID 130698488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).