(9-cyclopentyl-8-methylpurin-6-yl)azanide

C11H14N5- — CID 145422877

IUPAC(9-cyclopentyl-8-methylpurin-6-yl)azanide
SMILESCc1nc2c([NH-])ncnc2n1C1CCCC1
InChIInChI=1S/C11H14N5/c1-7-15-9-10(12)13-6-14-11(9)16(7)8-4-2-3-5-8/h6,8H,2-5H2,1H3,(H-,12,13,14)/q-1
InChIKeyFDFODEGVCDDZDT-UHFFFAOYSA-N
MW216.27 g/mol
LogP2.93
Rot. Bonds1

About (9-cyclopentyl-8-methylpurin-6-yl)azanide

(9-cyclopentyl-8-methylpurin-6-yl)azanide (PubChem CID 145422877) has the molecular formula C11H14N5- and a molecular weight of 216.27 g/mol. Its IUPAC name is (9-cyclopentyl-8-methylpurin-6-yl)azanide.

Molecular Properties

Compound Name(9-cyclopentyl-8-methylpurin-6-yl)azanide
PubChem CID145422877
Molecular FormulaC11H14N5-
Molecular Weight216.27 g/mol
Exact Mass216.13
IUPAC Name(9-cyclopentyl-8-methylpurin-6-yl)azanide
SMILESCc1nc2c([NH-])ncnc2n1C1CCCC1
InChIInChI=1S/C11H14N5/c1-7-15-9-10(12)13-6-14-11(9)16(7)8-4-2-3-5-8/h6,8H,2-5H2,1H3,(H-,12,13,14)/q-1
InChIKeyFDFODEGVCDDZDT-UHFFFAOYSA-N
XLogP2.93
TPSA67.40 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.27
LogP ≤ 52.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (9-cyclopentyl-8-methylpurin-6-yl)azanide?
The IUPAC name of (9-cyclopentyl-8-methylpurin-6-yl)azanide (CID 145422877) is (9-cyclopentyl-8-methylpurin-6-yl)azanide.
What is the SMILES notation for (9-cyclopentyl-8-methylpurin-6-yl)azanide?
The canonical SMILES for (9-cyclopentyl-8-methylpurin-6-yl)azanide is Cc1nc2c([NH-])ncnc2n1C1CCCC1.
What is the InChIKey of (9-cyclopentyl-8-methylpurin-6-yl)azanide?
The InChIKey is FDFODEGVCDDZDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N5/c1-7-15-9-10(12)13-6-14-11(9)16(7)8-4-2-3-5-8/h6,8H,2-5H2,1H3,(H-,12,13,14)/q-1.
What are the key properties of (9-cyclopentyl-8-methylpurin-6-yl)azanide?
(9-cyclopentyl-8-methylpurin-6-yl)azanide has a molecular weight of 216.27 g/mol, XLogP of 2.93, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (9-cyclopentyl-8-methylpurin-6-yl)azanide is sourced from PubChem (CID 145422877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).