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

C11H17N3 — CID 24930382

IUPAC2-methyl-7-propyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine
SMILESCCCN1CCc2cnc(C)nc2C1
InChIInChI=1S/C11H17N3/c1-3-5-14-6-4-10-7-12-9(2)13-11(10)8-14/h7H,3-6,8H2,1-2H3
InChIKeyVFDVPFPTVREOPO-UHFFFAOYSA-N
MW191.28 g/mol
LogP1.55
Rot. Bonds2

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

2-methyl-7-propyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine (PubChem CID 24930382) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is 2-methyl-7-propyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine.

Molecular Properties

Compound Name2-methyl-7-propyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine
PubChem CID24930382
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC Name2-methyl-7-propyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine
SMILESCCCN1CCc2cnc(C)nc2C1
InChIInChI=1S/C11H17N3/c1-3-5-14-6-4-10-7-12-9(2)13-11(10)8-14/h7H,3-6,8H2,1-2H3
InChIKeyVFDVPFPTVREOPO-UHFFFAOYSA-N
XLogP1.55
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 51.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-chlorophenyl)-7-propyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine
CID 24930380
7-[(4,6-dichloropyrimidin-5-yl)methyl]-2-methyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine
CID 24930865
6-propyl-2-(4-propylpiperazin-1-yl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 20960813
4-methyl-5-[(2-propyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)methyl]-1,3-thiazole
CID 24930897
1-[(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-2-(2-methyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)ethanone
CID 95285724
7-butyl-2-thiophen-2-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine
CID 24930423
7-[(6-bromo-1H-indol-3-yl)methyl]-2-methyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine
CID 24931180
methyl 3-[(2-methyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)methyl]benzoate
CID 24930235
4-methyl-5-[(2-propan-2-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)methyl]-1,3-thiazole
CID 24930908
6-[(2,5-dimethylpyrazol-3-yl)methyl]-2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 24912561
2-methyl-7-[(6-propan-2-yl-1H-indol-3-yl)methyl]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine
CID 24931243
7-ethyl-2-pyridin-4-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine
CID 24930411

Frequently Asked Questions

What is the IUPAC name of 2-methyl-7-propyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine?
The IUPAC name of 2-methyl-7-propyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine (CID 24930382) is 2-methyl-7-propyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine.
What is the SMILES notation for 2-methyl-7-propyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine?
The canonical SMILES for 2-methyl-7-propyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine is CCCN1CCc2cnc(C)nc2C1.
What is the InChIKey of 2-methyl-7-propyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine?
The InChIKey is VFDVPFPTVREOPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3/c1-3-5-14-6-4-10-7-12-9(2)13-11(10)8-14/h7H,3-6,8H2,1-2H3.
What are the key properties of 2-methyl-7-propyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine?
2-methyl-7-propyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine has a molecular weight of 191.28 g/mol, XLogP of 1.55, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-7-propyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine is sourced from PubChem (CID 24930382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).