3-cyclopropyl-5-propan-2-yl-2-propylimidazol-4-amine

C12H21N3 — CID 62218882

IUPAC3-cyclopropyl-5-propan-2-yl-2-propylimidazol-4-amine
SMILESCCCc1nc(C(C)C)c(N)n1C1CC1
InChIInChI=1S/C12H21N3/c1-4-5-10-14-11(8(2)3)12(13)15(10)9-6-7-9/h8-9H,4-7,13H2,1-3H3
InChIKeyHVWXYWOWHLWWMZ-UHFFFAOYSA-N
MW207.32 g/mol
LogP2.88
Rot. Bonds4

About 3-cyclopropyl-5-propan-2-yl-2-propylimidazol-4-amine

3-cyclopropyl-5-propan-2-yl-2-propylimidazol-4-amine (PubChem CID 62218882) has the molecular formula C12H21N3 and a molecular weight of 207.32 g/mol. Its IUPAC name is 3-cyclopropyl-5-propan-2-yl-2-propylimidazol-4-amine.

Molecular Properties

Compound Name3-cyclopropyl-5-propan-2-yl-2-propylimidazol-4-amine
PubChem CID62218882
Molecular FormulaC12H21N3
Molecular Weight207.32 g/mol
Exact Mass207.17
IUPAC Name3-cyclopropyl-5-propan-2-yl-2-propylimidazol-4-amine
SMILESCCCc1nc(C(C)C)c(N)n1C1CC1
InChIInChI=1S/C12H21N3/c1-4-5-10-14-11(8(2)3)12(13)15(10)9-6-7-9/h8-9H,4-7,13H2,1-3H3
InChIKeyHVWXYWOWHLWWMZ-UHFFFAOYSA-N
XLogP2.88
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-5-propan-2-yl-2-propylimidazol-4-amine?
The IUPAC name of 3-cyclopropyl-5-propan-2-yl-2-propylimidazol-4-amine (CID 62218882) is 3-cyclopropyl-5-propan-2-yl-2-propylimidazol-4-amine.
What is the SMILES notation for 3-cyclopropyl-5-propan-2-yl-2-propylimidazol-4-amine?
The canonical SMILES for 3-cyclopropyl-5-propan-2-yl-2-propylimidazol-4-amine is CCCc1nc(C(C)C)c(N)n1C1CC1.
What is the InChIKey of 3-cyclopropyl-5-propan-2-yl-2-propylimidazol-4-amine?
The InChIKey is HVWXYWOWHLWWMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3/c1-4-5-10-14-11(8(2)3)12(13)15(10)9-6-7-9/h8-9H,4-7,13H2,1-3H3.
What are the key properties of 3-cyclopropyl-5-propan-2-yl-2-propylimidazol-4-amine?
3-cyclopropyl-5-propan-2-yl-2-propylimidazol-4-amine has a molecular weight of 207.32 g/mol, XLogP of 2.88, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-5-propan-2-yl-2-propylimidazol-4-amine is sourced from PubChem (CID 62218882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).