8-(2-amino-4-pyridinyl)-5-methyl-2-(6-methyl-2-pyridinyl)-7H-pteridin-6-one

C18H17N7O — CID 163287320

IUPAC8-(2-amino-4-pyridinyl)-5-methyl-2-(6-methyl-2-pyridinyl)-7H-pteridin-6-one
SMILESCc1cccc(-c2ncc3c(n2)N(c2ccnc(N)c2)CC(=O)N3C)n1
InChIInChI=1S/C18H17N7O/c1-11-4-3-5-13(22-11)17-21-9-14-18(23-17)25(10-16(26)24(14)2)12-6-7-20-15(19)8-12/h3-9H,10H2,1-2H3,(H2,19,20)
InChIKeyMSWVHEUGUOBAJI-UHFFFAOYSA-N
MW347.38 g/mol
LogP1.94
Rot. Bonds2

About 8-(2-amino-4-pyridinyl)-5-methyl-2-(6-methyl-2-pyridinyl)-7H-pteridin-6-one

8-(2-amino-4-pyridinyl)-5-methyl-2-(6-methyl-2-pyridinyl)-7H-pteridin-6-one (PubChem CID 163287320) has the molecular formula C18H17N7O and a molecular weight of 347.38 g/mol. Its IUPAC name is 8-(2-amino-4-pyridinyl)-5-methyl-2-(6-methyl-2-pyridinyl)-7H-pteridin-6-one.

Molecular Properties

Compound Name8-(2-amino-4-pyridinyl)-5-methyl-2-(6-methyl-2-pyridinyl)-7H-pteridin-6-one
PubChem CID163287320
Molecular FormulaC18H17N7O
Molecular Weight347.38 g/mol
Exact Mass347.15
IUPAC Name8-(2-amino-4-pyridinyl)-5-methyl-2-(6-methyl-2-pyridinyl)-7H-pteridin-6-one
SMILESCc1cccc(-c2ncc3c(n2)N(c2ccnc(N)c2)CC(=O)N3C)n1
InChIInChI=1S/C18H17N7O/c1-11-4-3-5-13(22-11)17-21-9-14-18(23-17)25(10-16(26)24(14)2)12-6-7-20-15(19)8-12/h3-9H,10H2,1-2H3,(H2,19,20)
InChIKeyMSWVHEUGUOBAJI-UHFFFAOYSA-N
XLogP1.94
TPSA101.13 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.38
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-[3-methoxy-4-(4-methylpiperazin-1-yl)phenyl]-4-[2-(6-methyl-2-pyridinyl)-5,6-dihydropyrrolo[2,3-d]pyrimidin-7-yl]pyridin-2-amine
CID 163287379
4-N-[2-(6-methyl-2-pyridinyl)pyrimidin-4-yl]pyrimidine-2,4-diamine
CID 166035991
2-amino-5-methyl-9-phenyl-7,8-dihydropyrimido[4,5-b][1,4]diazepin-6-one
CID 68682098
5-methyl-2-(6-methyl-2-pyridinyl)pyrimidine
CID 170281119
N-(2-hydroxyethyl)-4-[5-methyl-2-(6-methyl-2-pyridinyl)-6,7-dihydropteridin-8-yl]pyridine-3-carboxamide
CID 163287384
2-(6-methyl-2-pyridinyl)-8-(1H-pyrrolo[2,3-b]pyridin-4-yl)-6,7-dihydro-5H-pyrido[2,3-d]pyrimidine
CID 163287329
4-(2-amino-4-pyridinyl)-1-methyl-1,4-diazepan-2-one
CID 102887615
N-(1-hydroxybutan-2-yl)-4-[5-methyl-2-(6-methyl-2-pyridinyl)-6,7-dihydropteridin-8-yl]pyridine-3-carboxamide
CID 163287333
[2-(6-methyl-2-pyridinyl)pyrimidin-5-yl]methanamine
CID 63555986
2-(6-methyl-2-pyridinyl)indeno[1,2-d]pyrimidin-5-one
CID 86166003
4-(4-methyl-3-pyridinyl)-2-(6-methyl-2-pyridinyl)pyrimidine
CID 175992294
2-piperazin-1-ylethyl 6-[[4-[[2-(6-methyl-2-pyridinyl)pyrimidin-4-yl]amino]pyrimidin-2-yl]amino]pyridine-3-carboxylate
CID 166035878

Frequently Asked Questions

What is the IUPAC name of 8-(2-amino-4-pyridinyl)-5-methyl-2-(6-methyl-2-pyridinyl)-7H-pteridin-6-one?
The IUPAC name of 8-(2-amino-4-pyridinyl)-5-methyl-2-(6-methyl-2-pyridinyl)-7H-pteridin-6-one (CID 163287320) is 8-(2-amino-4-pyridinyl)-5-methyl-2-(6-methyl-2-pyridinyl)-7H-pteridin-6-one.
What is the SMILES notation for 8-(2-amino-4-pyridinyl)-5-methyl-2-(6-methyl-2-pyridinyl)-7H-pteridin-6-one?
The canonical SMILES for 8-(2-amino-4-pyridinyl)-5-methyl-2-(6-methyl-2-pyridinyl)-7H-pteridin-6-one is Cc1cccc(-c2ncc3c(n2)N(c2ccnc(N)c2)CC(=O)N3C)n1.
What is the InChIKey of 8-(2-amino-4-pyridinyl)-5-methyl-2-(6-methyl-2-pyridinyl)-7H-pteridin-6-one?
The InChIKey is MSWVHEUGUOBAJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N7O/c1-11-4-3-5-13(22-11)17-21-9-14-18(23-17)25(10-16(26)24(14)2)12-6-7-20-15(19)8-12/h3-9H,10H2,1-2H3,(H2,19,20).
What are the key properties of 8-(2-amino-4-pyridinyl)-5-methyl-2-(6-methyl-2-pyridinyl)-7H-pteridin-6-one?
8-(2-amino-4-pyridinyl)-5-methyl-2-(6-methyl-2-pyridinyl)-7H-pteridin-6-one has a molecular weight of 347.38 g/mol, XLogP of 1.94, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(2-amino-4-pyridinyl)-5-methyl-2-(6-methyl-2-pyridinyl)-7H-pteridin-6-one is sourced from PubChem (CID 163287320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).