3,5-dicyclopropylimidazol-4-amine

C9H13N3 — CID 62075331

IUPAC3,5-dicyclopropylimidazol-4-amine
SMILESNc1c(C2CC2)ncn1C1CC1
InChIInChI=1S/C9H13N3/c10-9-8(6-1-2-6)11-5-12(9)7-3-4-7/h5-7H,1-4,10H2
InChIKeyDMSJBVIKWHCEHE-UHFFFAOYSA-N
MW163.22 g/mol
LogP1.68
Rot. Bonds2

About 3,5-dicyclopropylimidazol-4-amine

3,5-dicyclopropylimidazol-4-amine (PubChem CID 62075331) has the molecular formula C9H13N3 and a molecular weight of 163.22 g/mol. Its IUPAC name is 3,5-dicyclopropylimidazol-4-amine.

Molecular Properties

Compound Name3,5-dicyclopropylimidazol-4-amine
PubChem CID62075331
Molecular FormulaC9H13N3
Molecular Weight163.22 g/mol
Exact Mass163.11
IUPAC Name3,5-dicyclopropylimidazol-4-amine
SMILESNc1c(C2CC2)ncn1C1CC1
InChIInChI=1S/C9H13N3/c10-9-8(6-1-2-6)11-5-12(9)7-3-4-7/h5-7H,1-4,10H2
InChIKeyDMSJBVIKWHCEHE-UHFFFAOYSA-N
XLogP1.68
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.22
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3,5-dicyclopropylimidazol-4-amine?
The IUPAC name of 3,5-dicyclopropylimidazol-4-amine (CID 62075331) is 3,5-dicyclopropylimidazol-4-amine.
What is the SMILES notation for 3,5-dicyclopropylimidazol-4-amine?
The canonical SMILES for 3,5-dicyclopropylimidazol-4-amine is Nc1c(C2CC2)ncn1C1CC1.
What is the InChIKey of 3,5-dicyclopropylimidazol-4-amine?
The InChIKey is DMSJBVIKWHCEHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3/c10-9-8(6-1-2-6)11-5-12(9)7-3-4-7/h5-7H,1-4,10H2.
What are the key properties of 3,5-dicyclopropylimidazol-4-amine?
3,5-dicyclopropylimidazol-4-amine has a molecular weight of 163.22 g/mol, XLogP of 1.68, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dicyclopropylimidazol-4-amine is sourced from PubChem (CID 62075331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).