2,4-dimethoxy-7-methyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine

C10H15N3O2 — CID 170416269

IUPAC2,4-dimethoxy-7-methyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine
SMILESCOc1nc2c(c(OC)n1)CCN(C)C2
InChIInChI=1S/C10H15N3O2/c1-13-5-4-7-8(6-13)11-10(15-3)12-9(7)14-2/h4-6H2,1-3H3
InChIKeyAFAVIQOZVCSMJN-UHFFFAOYSA-N
MW209.25 g/mol
LogP0.48
Rot. Bonds2

About 2,4-dimethoxy-7-methyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine

2,4-dimethoxy-7-methyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine (PubChem CID 170416269) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is 2,4-dimethoxy-7-methyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine.

Molecular Properties

Compound Name2,4-dimethoxy-7-methyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine
PubChem CID170416269
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC Name2,4-dimethoxy-7-methyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine
SMILESCOc1nc2c(c(OC)n1)CCN(C)C2
InChIInChI=1S/C10H15N3O2/c1-13-5-4-7-8(6-13)11-10(15-3)12-9(7)14-2/h4-6H2,1-3H3
InChIKeyAFAVIQOZVCSMJN-UHFFFAOYSA-N
XLogP0.48
TPSA47.48 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 50.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

4-Methoxy-2-(piperazin-1-yl)-5,6,7,8-tetrahydroquinazoline
CID 498210
5-(2-Fluoroethyl)-2,4-dimethoxy-6-methylpyrimidine
CID 46885008
2-chloro-4-methoxy-5H,6H,7H,8H-pyrido[4,3-d]pyrimidinehydrochloride
CID 155820520
(S)-4-Methoxy-2-[(1-methyl-2-pyrrolidinyl)methoxy]-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine
CID 154718165
4-Methoxy-2-(trifluoromethyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine
CID 18456522
4-Methoxy-2-propan-2-yl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine;2,2,2-trifluoroacetic acid
CID 138635934
4-Methoxy-2-(trifluoromethyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine;hydrochloride
CID 140041721
2,4-dimethoxy-5-(trifluoromethyl)-7H-pyrrolo[3,4-d]pyrimidine
CID 160399616
tert-butyl 4-methoxy-2-(3,3,3-trifluoropropoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine-7-carboxylate
CID 163223046
tert-butyl 4-methoxy-2-(3,3,3-trifluoropropoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine-7-carboxylate;ethane
CID 163223212
4-Methoxy-2-(3,3,3-trifluoropropoxy)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine
CID 163223550
2-fluoro-7-methyl-4-propan-2-yloxy-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine
CID 172576417

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethoxy-7-methyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine?
The IUPAC name of 2,4-dimethoxy-7-methyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine (CID 170416269) is 2,4-dimethoxy-7-methyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine.
What is the SMILES notation for 2,4-dimethoxy-7-methyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine?
The canonical SMILES for 2,4-dimethoxy-7-methyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine is COc1nc2c(c(OC)n1)CCN(C)C2.
What is the InChIKey of 2,4-dimethoxy-7-methyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine?
The InChIKey is AFAVIQOZVCSMJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c1-13-5-4-7-8(6-13)11-10(15-3)12-9(7)14-2/h4-6H2,1-3H3.
What are the key properties of 2,4-dimethoxy-7-methyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine?
2,4-dimethoxy-7-methyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine has a molecular weight of 209.25 g/mol, XLogP of 0.48, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethoxy-7-methyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine is sourced from PubChem (CID 170416269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).