N,5-dicyclopentyl-4-ethyl-4H-[1,2,4]triazolo[4,3-f]pteridin-7-amine

C19H27N7 — CID 66672557

IUPACN,5-dicyclopentyl-4-ethyl-4H-[1,2,4]triazolo[4,3-f]pteridin-7-amine
SMILESCCC1c2nncn2-c2cnc(NC3CCCC3)nc2N1C1CCCC1
InChIInChI=1S/C19H27N7/c1-2-15-18-24-21-12-25(18)16-11-20-19(22-13-7-3-4-8-13)23-17(16)26(15)14-9-5-6-10-14/h11-15H,2-10H2,1H3,(H,20,22,23)
InChIKeyPANLPXCOOSGLCK-UHFFFAOYSA-N
MW353.47 g/mol
LogP3.63
Rot. Bonds4

About N,5-dicyclopentyl-4-ethyl-4H-[1,2,4]triazolo[4,3-f]pteridin-7-amine

N,5-dicyclopentyl-4-ethyl-4H-[1,2,4]triazolo[4,3-f]pteridin-7-amine (PubChem CID 66672557) has the molecular formula C19H27N7 and a molecular weight of 353.47 g/mol. Its IUPAC name is N,5-dicyclopentyl-4-ethyl-4H-[1,2,4]triazolo[4,3-f]pteridin-7-amine.

Molecular Properties

Compound NameN,5-dicyclopentyl-4-ethyl-4H-[1,2,4]triazolo[4,3-f]pteridin-7-amine
PubChem CID66672557
Molecular FormulaC19H27N7
Molecular Weight353.47 g/mol
Exact Mass353.23
IUPAC NameN,5-dicyclopentyl-4-ethyl-4H-[1,2,4]triazolo[4,3-f]pteridin-7-amine
SMILESCCC1c2nncn2-c2cnc(NC3CCCC3)nc2N1C1CCCC1
InChIInChI=1S/C19H27N7/c1-2-15-18-24-21-12-25(18)16-11-20-19(22-13-7-3-4-8-13)23-17(16)26(15)14-9-5-6-10-14/h11-15H,2-10H2,1H3,(H,20,22,23)
InChIKeyPANLPXCOOSGLCK-UHFFFAOYSA-N
XLogP3.63
TPSA71.76 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.47
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N,5-dicyclopentyl-4-ethyl-4H-[1,2,4]triazolo[4,3-f]pteridin-7-amine with MolForge

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Related Compounds

methyl N-[(4R)-5-cyclopentyl-4-ethyl-4H-[1,2,4]triazolo[4,3-f]pteridin-7-yl]carbamate
CID 24890789
5-cyclobutyl-4-ethyl-4H-[1,2,4]triazolo[4,3-f]pteridin-7-amine
CID 141194019
5-cyclopentyl-4-ethyl-4H-[1,2,4]triazolo[4,3-f]pteridine
CID 123214877
(4R)-5-cyclopentyl-4-ethyl-N-(4-pyrazol-1-ylphenyl)-4H-[1,2,4]triazolo[4,3-f]pteridin-7-amine
CID 24888399
4-[(4R)-5-cyclopentyl-4-ethyl-4H-[1,2,4]triazolo[4,3-f]pteridin-7-yl]-N-methylpyridin-2-amine
CID 67122143
(4R)-5-cyclopentyl-4-ethyl-7-(1-oxidopyridin-1-ium-4-yl)-4H-[1,2,4]triazolo[4,3-f]pteridine
CID 67499872
(4R)-5-cyclopentyl-4-ethyl-7-indol-1-yl-4H-[1,2,4]triazolo[4,3-f]pteridine
CID 66979801
4-[(5-cyclopentyl-4-ethyl-4H-[1,2,4]triazolo[4,3-f]pteridin-7-yl)amino]-3-methoxy-N-methylbenzamide
CID 66672556
5-cyclopentyl-4-ethyl-7-(2-pyrrolidin-1-ylimidazol-1-yl)-4H-[1,2,4]triazolo[4,3-f]pteridine
CID 67499398
4-(5-cyclopentyl-4-ethyl-4H-[1,2,4]triazolo[4,3-f]pteridin-7-yl)pyridin-3-amine
CID 66979234
5-cyclopentyl-4-ethyl-7-(2-phenylpropyl)-4H-[1,2,4]triazolo[4,3-f]pteridine
CID 158045627
5-cyclopentyl-4-ethyl-7-(2-methoxy-4-pyridinyl)-4H-[1,2,4]triazolo[4,3-f]pteridine
CID 67499430

Frequently Asked Questions

What is the IUPAC name of N,5-dicyclopentyl-4-ethyl-4H-[1,2,4]triazolo[4,3-f]pteridin-7-amine?
The IUPAC name of N,5-dicyclopentyl-4-ethyl-4H-[1,2,4]triazolo[4,3-f]pteridin-7-amine (CID 66672557) is N,5-dicyclopentyl-4-ethyl-4H-[1,2,4]triazolo[4,3-f]pteridin-7-amine.
What is the SMILES notation for N,5-dicyclopentyl-4-ethyl-4H-[1,2,4]triazolo[4,3-f]pteridin-7-amine?
The canonical SMILES for N,5-dicyclopentyl-4-ethyl-4H-[1,2,4]triazolo[4,3-f]pteridin-7-amine is CCC1c2nncn2-c2cnc(NC3CCCC3)nc2N1C1CCCC1.
What is the InChIKey of N,5-dicyclopentyl-4-ethyl-4H-[1,2,4]triazolo[4,3-f]pteridin-7-amine?
The InChIKey is PANLPXCOOSGLCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N7/c1-2-15-18-24-21-12-25(18)16-11-20-19(22-13-7-3-4-8-13)23-17(16)26(15)14-9-5-6-10-14/h11-15H,2-10H2,1H3,(H,20,22,23).
What are the key properties of N,5-dicyclopentyl-4-ethyl-4H-[1,2,4]triazolo[4,3-f]pteridin-7-amine?
N,5-dicyclopentyl-4-ethyl-4H-[1,2,4]triazolo[4,3-f]pteridin-7-amine has a molecular weight of 353.47 g/mol, XLogP of 3.63, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N,5-dicyclopentyl-4-ethyl-4H-[1,2,4]triazolo[4,3-f]pteridin-7-amine is sourced from PubChem (CID 66672557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).