1H-imidazo[2,1-f]purin-5-amine

C7H6N6 — CID 11148016

IUPAC1H-imidazo[2,1-f]purin-5-amine
SMILESNc1nc2nc[nH]c2c2nccn12
InChIInChI=1S/C7H6N6/c8-7-12-5-4(10-3-11-5)6-9-1-2-13(6)7/h1-3H,(H2,8,12)(H,10,11)
InChIKeyROPMUBAWZLJLRD-UHFFFAOYSA-N
MW174.17 g/mol
LogP0.19
Rot. Bonds

About 1H-imidazo[2,1-f]purin-5-amine

1H-imidazo[2,1-f]purin-5-amine (PubChem CID 11148016) has the molecular formula C7H6N6 and a molecular weight of 174.17 g/mol. Its IUPAC name is 1H-imidazo[2,1-f]purin-5-amine.

Molecular Properties

Compound Name1H-imidazo[2,1-f]purin-5-amine
PubChem CID11148016
Molecular FormulaC7H6N6
Molecular Weight174.17 g/mol
Exact Mass174.07
IUPAC Name1H-imidazo[2,1-f]purin-5-amine
SMILESNc1nc2nc[nH]c2c2nccn12
InChIInChI=1S/C7H6N6/c8-7-12-5-4(10-3-11-5)6-9-1-2-13(6)7/h1-3H,(H2,8,12)(H,10,11)
InChIKeyROPMUBAWZLJLRD-UHFFFAOYSA-N
XLogP0.19
TPSA84.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.17
LogP ≤ 50.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1,2-diamino-7H-purin-6-one
CID 15628862
imidazo[1,2-c]quinazolin-5-amine;hydrobromide
CID 66594113
bis(2-amino-1-hydroxy-7H-purin-6-one);hydrate
CID 67908400
8-phenyl-1H-[1,2,4]triazolo[5,1-f]purin-5-amine
CID 135597547
2-amino-1-ethyl-7H-purin-6-one
CID 18378033
imidazo[1,2-c]pyrimidine-5,8-diamine
CID 139427625
magnesium;2-amino-1,7-dihydropurin-6-one;dichloride
CID 174866452
6-N-fluoro-7H-purine-2,6-diamine
CID 143836083
2-amino-1-cyclopentyl-7H-purin-6-one
CID 71283680
2-amino-1-ethoxy-7H-purin-6-one
CID 174590702
2-amino-1-[[1-(hydroxymethyl)cyclopropyl]methyl]-7H-purin-6-one
CID 70210832
2-amino-1-benzylsulfanyl-7H-purin-6-one
CID 21115330

Frequently Asked Questions

What is the IUPAC name of 1H-imidazo[2,1-f]purin-5-amine?
The IUPAC name of 1H-imidazo[2,1-f]purin-5-amine (CID 11148016) is 1H-imidazo[2,1-f]purin-5-amine.
What is the SMILES notation for 1H-imidazo[2,1-f]purin-5-amine?
The canonical SMILES for 1H-imidazo[2,1-f]purin-5-amine is Nc1nc2nc[nH]c2c2nccn12.
What is the InChIKey of 1H-imidazo[2,1-f]purin-5-amine?
The InChIKey is ROPMUBAWZLJLRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6N6/c8-7-12-5-4(10-3-11-5)6-9-1-2-13(6)7/h1-3H,(H2,8,12)(H,10,11).
What are the key properties of 1H-imidazo[2,1-f]purin-5-amine?
1H-imidazo[2,1-f]purin-5-amine has a molecular weight of 174.17 g/mol, XLogP of 0.19, 0 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1H-imidazo[2,1-f]purin-5-amine is sourced from PubChem (CID 11148016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).