3-cyclopropyl-5-(3-cyclopropylimidazol-4-yl)-2-propan-2-ylimidazol-4-amine

C15H21N5 — CID 66162715

IUPAC3-cyclopropyl-5-(3-cyclopropylimidazol-4-yl)-2-propan-2-ylimidazol-4-amine
SMILESCC(C)c1nc(-c2cncn2C2CC2)c(N)n1C1CC1
InChIInChI=1S/C15H21N5/c1-9(2)15-18-13(14(16)20(15)11-5-6-11)12-7-17-8-19(12)10-3-4-10/h7-11H,3-6,16H2,1-2H3
InChIKeyGBJUJGOVDGHWGJ-UHFFFAOYSA-N
MW271.37 g/mol
LogP3.12
Rot. Bonds4

About 3-cyclopropyl-5-(3-cyclopropylimidazol-4-yl)-2-propan-2-ylimidazol-4-amine

3-cyclopropyl-5-(3-cyclopropylimidazol-4-yl)-2-propan-2-ylimidazol-4-amine (PubChem CID 66162715) has the molecular formula C15H21N5 and a molecular weight of 271.37 g/mol. Its IUPAC name is 3-cyclopropyl-5-(3-cyclopropylimidazol-4-yl)-2-propan-2-ylimidazol-4-amine.

Molecular Properties

Compound Name3-cyclopropyl-5-(3-cyclopropylimidazol-4-yl)-2-propan-2-ylimidazol-4-amine
PubChem CID66162715
Molecular FormulaC15H21N5
Molecular Weight271.37 g/mol
Exact Mass271.18
IUPAC Name3-cyclopropyl-5-(3-cyclopropylimidazol-4-yl)-2-propan-2-ylimidazol-4-amine
SMILESCC(C)c1nc(-c2cncn2C2CC2)c(N)n1C1CC1
InChIInChI=1S/C15H21N5/c1-9(2)15-18-13(14(16)20(15)11-5-6-11)12-7-17-8-19(12)10-3-4-10/h7-11H,3-6,16H2,1-2H3
InChIKeyGBJUJGOVDGHWGJ-UHFFFAOYSA-N
XLogP3.12
TPSA61.66 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.37
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-5-(3-cyclopropylimidazol-4-yl)-2-propan-2-ylimidazol-4-amine?
The IUPAC name of 3-cyclopropyl-5-(3-cyclopropylimidazol-4-yl)-2-propan-2-ylimidazol-4-amine (CID 66162715) is 3-cyclopropyl-5-(3-cyclopropylimidazol-4-yl)-2-propan-2-ylimidazol-4-amine.
What is the SMILES notation for 3-cyclopropyl-5-(3-cyclopropylimidazol-4-yl)-2-propan-2-ylimidazol-4-amine?
The canonical SMILES for 3-cyclopropyl-5-(3-cyclopropylimidazol-4-yl)-2-propan-2-ylimidazol-4-amine is CC(C)c1nc(-c2cncn2C2CC2)c(N)n1C1CC1.
What is the InChIKey of 3-cyclopropyl-5-(3-cyclopropylimidazol-4-yl)-2-propan-2-ylimidazol-4-amine?
The InChIKey is GBJUJGOVDGHWGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5/c1-9(2)15-18-13(14(16)20(15)11-5-6-11)12-7-17-8-19(12)10-3-4-10/h7-11H,3-6,16H2,1-2H3.
What are the key properties of 3-cyclopropyl-5-(3-cyclopropylimidazol-4-yl)-2-propan-2-ylimidazol-4-amine?
3-cyclopropyl-5-(3-cyclopropylimidazol-4-yl)-2-propan-2-ylimidazol-4-amine has a molecular weight of 271.37 g/mol, XLogP of 3.12, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-5-(3-cyclopropylimidazol-4-yl)-2-propan-2-ylimidazol-4-amine is sourced from PubChem (CID 66162715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).