2-cyclopropyl-4-isoquinolin-4-ylimidazole-1,5-diamine

C15H15N5 — CID 104504833

IUPAC2-cyclopropyl-4-isoquinolin-4-ylimidazole-1,5-diamine
SMILESNc1c(-c2cncc3ccccc23)nc(C2CC2)n1N
InChIInChI=1S/C15H15N5/c16-14-13(19-15(20(14)17)9-5-6-9)12-8-18-7-10-3-1-2-4-11(10)12/h1-4,7-9H,5-6,16-17H2
InChIKeyCFXBYJNPTZZXJS-UHFFFAOYSA-N
MW265.32 g/mol
LogP2.27
Rot. Bonds2

About 2-cyclopropyl-4-isoquinolin-4-ylimidazole-1,5-diamine

2-cyclopropyl-4-isoquinolin-4-ylimidazole-1,5-diamine (PubChem CID 104504833) has the molecular formula C15H15N5 and a molecular weight of 265.32 g/mol. Its IUPAC name is 2-cyclopropyl-4-isoquinolin-4-ylimidazole-1,5-diamine.

Molecular Properties

Compound Name2-cyclopropyl-4-isoquinolin-4-ylimidazole-1,5-diamine
PubChem CID104504833
Molecular FormulaC15H15N5
Molecular Weight265.32 g/mol
Exact Mass265.13
IUPAC Name2-cyclopropyl-4-isoquinolin-4-ylimidazole-1,5-diamine
SMILESNc1c(-c2cncc3ccccc23)nc(C2CC2)n1N
InChIInChI=1S/C15H15N5/c16-14-13(19-15(20(14)17)9-5-6-9)12-8-18-7-10-3-1-2-4-11(10)12/h1-4,7-9H,5-6,16-17H2
InChIKeyCFXBYJNPTZZXJS-UHFFFAOYSA-N
XLogP2.27
TPSA82.75 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-isoquinolin-4-yl-2-methylimidazole-1,5-diamine
CID 104504831
5-isoquinolin-4-yl-2,3-dimethylimidazol-4-amine
CID 104504804
2-cyclopropyl-4-(2-ethoxyphenyl)imidazole-1,5-diamine
CID 62482562
5-isoquinolin-4-yl-3-propan-2-ylimidazol-4-amine
CID 104504799
2-isoquinolin-4-yl-8-methylimidazo[1,2-a]pyridin-3-amine
CID 104505099
3-isoquinolin-4-ylaniline
CID 22724137
4-(1,5-diamino-2-cyclopropylimidazol-4-yl)benzonitrile
CID 62483808
2-cyclohexyl-4-(2,5-dimethylphenyl)imidazole-1,5-diamine
CID 62506117
4-isoquinolin-4-ylcyclohexan-1-amine
CID 83261369
5-chloro-4-isoquinolin-4-ylpyrimidin-2-amine
CID 166661287
5-isoquinolin-4-yl-3-prop-2-ynylimidazol-4-amine
CID 104504813
2-cyclopropyl-4-(3-propylimidazol-4-yl)imidazole-1,5-diamine
CID 66131553

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-4-isoquinolin-4-ylimidazole-1,5-diamine?
The IUPAC name of 2-cyclopropyl-4-isoquinolin-4-ylimidazole-1,5-diamine (CID 104504833) is 2-cyclopropyl-4-isoquinolin-4-ylimidazole-1,5-diamine.
What is the SMILES notation for 2-cyclopropyl-4-isoquinolin-4-ylimidazole-1,5-diamine?
The canonical SMILES for 2-cyclopropyl-4-isoquinolin-4-ylimidazole-1,5-diamine is Nc1c(-c2cncc3ccccc23)nc(C2CC2)n1N.
What is the InChIKey of 2-cyclopropyl-4-isoquinolin-4-ylimidazole-1,5-diamine?
The InChIKey is CFXBYJNPTZZXJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N5/c16-14-13(19-15(20(14)17)9-5-6-9)12-8-18-7-10-3-1-2-4-11(10)12/h1-4,7-9H,5-6,16-17H2.
What are the key properties of 2-cyclopropyl-4-isoquinolin-4-ylimidazole-1,5-diamine?
2-cyclopropyl-4-isoquinolin-4-ylimidazole-1,5-diamine has a molecular weight of 265.32 g/mol, XLogP of 2.27, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-4-isoquinolin-4-ylimidazole-1,5-diamine is sourced from PubChem (CID 104504833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).