[1,2,4]triazolo[1,5-c]pteridin-2-amine

C7H5N7 — CID 639080

IUPAC[1,2,4]triazolo[1,5-c]pteridin-2-amine
SMILESNc1nc2c3nccnc3ncn2n1
InChIInChI=1S/C7H5N7/c8-7-12-6-4-5(10-2-1-9-4)11-3-14(6)13-7/h1-3H,(H2,8,13)
InChIKeyUMMPUXDHTGWRAW-UHFFFAOYSA-N
MW187.17 g/mol
LogP-0.35
Rot. Bonds

About [1,2,4]triazolo[1,5-c]pteridin-2-amine

[1,2,4]triazolo[1,5-c]pteridin-2-amine (PubChem CID 639080) has the molecular formula C7H5N7 and a molecular weight of 187.17 g/mol. Its IUPAC name is [1,2,4]triazolo[1,5-c]pteridin-2-amine.

Molecular Properties

Compound Name[1,2,4]triazolo[1,5-c]pteridin-2-amine
PubChem CID639080
Molecular FormulaC7H5N7
Molecular Weight187.17 g/mol
Exact Mass187.06
IUPAC Name[1,2,4]triazolo[1,5-c]pteridin-2-amine
SMILESNc1nc2c3nccnc3ncn2n1
InChIInChI=1S/C7H5N7/c8-7-12-6-4-5(10-2-1-9-4)11-3-14(6)13-7/h1-3H,(H2,8,13)
InChIKeyUMMPUXDHTGWRAW-UHFFFAOYSA-N
XLogP-0.35
TPSA94.88 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.17
LogP ≤ 5-0.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

2,4-Diaminopteridine
CID 348669
Triazolopyrimidine
CID 64962
4-Pteridinamine
CID 81449
Pteridin-2-amine
CID 907652
4,7-Diaza-1H-indazole
CID 12913751
1-methyl-1H-pyrazolo(3,4-b)pyrazine
CID 59421494
Pyrazolo(1,5-a)pyrimidin-6-amine
CID 25247836
1h-Pyrazolo[3,4-b]pyrazin-3-amine
CID 294464
1-Methyl-6-(trichloromethyl)pyrazolo[3,4-b]pyrazin-3-amine
CID 296470
7H-triazolo[5,1-f][1,2,4]triazine-4,6-diimine
CID 246909
Pyrazolo[1,5-a]pyrimidin-3-amine
CID 21192071
5-Piperidin-1-ylpyrazolo[1,5-a]pyrimidin-3-amine
CID 176142005

Frequently Asked Questions

What is the IUPAC name of [1,2,4]triazolo[1,5-c]pteridin-2-amine?
The IUPAC name of [1,2,4]triazolo[1,5-c]pteridin-2-amine (CID 639080) is [1,2,4]triazolo[1,5-c]pteridin-2-amine.
What is the SMILES notation for [1,2,4]triazolo[1,5-c]pteridin-2-amine?
The canonical SMILES for [1,2,4]triazolo[1,5-c]pteridin-2-amine is Nc1nc2c3nccnc3ncn2n1.
What is the InChIKey of [1,2,4]triazolo[1,5-c]pteridin-2-amine?
The InChIKey is UMMPUXDHTGWRAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5N7/c8-7-12-6-4-5(10-2-1-9-4)11-3-14(6)13-7/h1-3H,(H2,8,13).
What are the key properties of [1,2,4]triazolo[1,5-c]pteridin-2-amine?
[1,2,4]triazolo[1,5-c]pteridin-2-amine has a molecular weight of 187.17 g/mol, XLogP of -0.35, 0 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [1,2,4]triazolo[1,5-c]pteridin-2-amine is sourced from PubChem (CID 639080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).