N-cyclopentyl-4-cyclopentylimino-2,3-dihydro-1H-imidazo[1,5-d][1,2,4]triazin-1-amine

C15H24N6 — CID 135898799

IUPACN-cyclopentyl-4-cyclopentylimino-2,3-dihydro-1H-imidazo[1,5-d][1,2,4]triazin-1-amine
SMILESc1ncn2c1C(NC1CCCC1)NN/C2=N\C1CCCC1
InChIInChI=1S/C15H24N6/c1-2-6-11(5-1)17-14-13-9-16-10-21(13)15(20-19-14)18-12-7-3-4-8-12/h9-12,14,17,19H,1-8H2,(H,18,20)
InChIKeyPHUXRCZXIUAHOS-UHFFFAOYSA-N
MW288.40 g/mol
LogP1.67
Rot. Bonds3

About N-cyclopentyl-4-cyclopentylimino-2,3-dihydro-1H-imidazo[1,5-d][1,2,4]triazin-1-amine

N-cyclopentyl-4-cyclopentylimino-2,3-dihydro-1H-imidazo[1,5-d][1,2,4]triazin-1-amine (PubChem CID 135898799) has the molecular formula C15H24N6 and a molecular weight of 288.40 g/mol. Its IUPAC name is N-cyclopentyl-4-cyclopentylimino-2,3-dihydro-1H-imidazo[1,5-d][1,2,4]triazin-1-amine.

Molecular Properties

Compound NameN-cyclopentyl-4-cyclopentylimino-2,3-dihydro-1H-imidazo[1,5-d][1,2,4]triazin-1-amine
PubChem CID135898799
Molecular FormulaC15H24N6
Molecular Weight288.40 g/mol
Exact Mass288.21
IUPAC NameN-cyclopentyl-4-cyclopentylimino-2,3-dihydro-1H-imidazo[1,5-d][1,2,4]triazin-1-amine
SMILESc1ncn2c1C(NC1CCCC1)NN/C2=N\C1CCCC1
InChIInChI=1S/C15H24N6/c1-2-6-11(5-1)17-14-13-9-16-10-21(13)15(20-19-14)18-12-7-3-4-8-12/h9-12,14,17,19H,1-8H2,(H,18,20)
InChIKeyPHUXRCZXIUAHOS-UHFFFAOYSA-N
XLogP1.67
TPSA66.27 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.40
LogP ≤ 51.67
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-4-cyclopentylimino-2,3-dihydro-1H-imidazo[1,5-d][1,2,4]triazin-1-amine?
The IUPAC name of N-cyclopentyl-4-cyclopentylimino-2,3-dihydro-1H-imidazo[1,5-d][1,2,4]triazin-1-amine (CID 135898799) is N-cyclopentyl-4-cyclopentylimino-2,3-dihydro-1H-imidazo[1,5-d][1,2,4]triazin-1-amine.
What is the SMILES notation for N-cyclopentyl-4-cyclopentylimino-2,3-dihydro-1H-imidazo[1,5-d][1,2,4]triazin-1-amine?
The canonical SMILES for N-cyclopentyl-4-cyclopentylimino-2,3-dihydro-1H-imidazo[1,5-d][1,2,4]triazin-1-amine is c1ncn2c1C(NC1CCCC1)NN/C2=N\C1CCCC1.
What is the InChIKey of N-cyclopentyl-4-cyclopentylimino-2,3-dihydro-1H-imidazo[1,5-d][1,2,4]triazin-1-amine?
The InChIKey is PHUXRCZXIUAHOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N6/c1-2-6-11(5-1)17-14-13-9-16-10-21(13)15(20-19-14)18-12-7-3-4-8-12/h9-12,14,17,19H,1-8H2,(H,18,20).
What are the key properties of N-cyclopentyl-4-cyclopentylimino-2,3-dihydro-1H-imidazo[1,5-d][1,2,4]triazin-1-amine?
N-cyclopentyl-4-cyclopentylimino-2,3-dihydro-1H-imidazo[1,5-d][1,2,4]triazin-1-amine has a molecular weight of 288.40 g/mol, XLogP of 1.67, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-4-cyclopentylimino-2,3-dihydro-1H-imidazo[1,5-d][1,2,4]triazin-1-amine is sourced from PubChem (CID 135898799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).