6-[(3-methylimidazo[1,5-a]pyridin-1-yl)methyl]-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine

C22H21N5 — CID 24915169

IUPAC6-[(3-methylimidazo[1,5-a]pyridin-1-yl)methyl]-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
SMILESCc1nc(CN2CCc3nc(-c4ccccc4)ncc3C2)c2ccccn12
InChIInChI=1S/C22H21N5/c1-16-24-20(21-9-5-6-11-27(16)21)15-26-12-10-19-18(14-26)13-23-22(25-19)17-7-3-2-4-8-17/h2-9,11,13H,10,12,14-15H2,1H3
InChIKeyZOEVWHGEUNFMLT-UHFFFAOYSA-N
MW355.45 g/mol
LogP3.66
Rot. Bonds3

About 6-[(3-methylimidazo[1,5-a]pyridin-1-yl)methyl]-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine

6-[(3-methylimidazo[1,5-a]pyridin-1-yl)methyl]-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine (PubChem CID 24915169) has the molecular formula C22H21N5 and a molecular weight of 355.45 g/mol. Its IUPAC name is 6-[(3-methylimidazo[1,5-a]pyridin-1-yl)methyl]-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine.

Molecular Properties

Compound Name6-[(3-methylimidazo[1,5-a]pyridin-1-yl)methyl]-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
PubChem CID24915169
Molecular FormulaC22H21N5
Molecular Weight355.45 g/mol
Exact Mass355.18
IUPAC Name6-[(3-methylimidazo[1,5-a]pyridin-1-yl)methyl]-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
SMILESCc1nc(CN2CCc3nc(-c4ccccc4)ncc3C2)c2ccccn12
InChIInChI=1S/C22H21N5/c1-16-24-20(21-9-5-6-11-27(16)21)15-26-12-10-19-18(14-26)13-23-22(25-19)17-7-3-2-4-8-17/h2-9,11,13H,10,12,14-15H2,1H3
InChIKeyZOEVWHGEUNFMLT-UHFFFAOYSA-N
XLogP3.66
TPSA46.32 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.45
LogP ≤ 53.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

6-[(3-methylimidazo[1,5-a]pyridin-1-yl)methyl]-2-propan-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 24915166
2-cyclohexyl-6-[(3-methylimidazo[1,5-a]pyridin-1-yl)methyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 24915182
6-[(3-methylimidazo[1,5-a]pyridin-1-yl)methyl]-2-phenyl-3,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one
CID 135946543
2-phenyl-6-[(2-phenylpyrimidin-5-yl)methyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 24912922
2-methyl-6-[(2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)methyl]phenol
CID 24929641
6-[(3-fluoro-2-pyridinyl)methyl]-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 24917268
3-methyl-5-phenyl-4-[(2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)methyl]-1,2-oxazole
CID 24912943
6-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2-pyridin-3-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 24912317
6-[(2-ethoxyphenyl)methyl]-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 24929368
6-[(5-bromofuran-2-yl)methyl]-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 24910108
2-(4-chlorophenyl)-6-[(1-methylindol-3-yl)methyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 24909054
4-[6-(pyrazolo[1,5-a]pyridin-3-ylmethyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-yl]aniline
CID 24915978

Frequently Asked Questions

What is the IUPAC name of 6-[(3-methylimidazo[1,5-a]pyridin-1-yl)methyl]-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine?
The IUPAC name of 6-[(3-methylimidazo[1,5-a]pyridin-1-yl)methyl]-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine (CID 24915169) is 6-[(3-methylimidazo[1,5-a]pyridin-1-yl)methyl]-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine.
What is the SMILES notation for 6-[(3-methylimidazo[1,5-a]pyridin-1-yl)methyl]-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine?
The canonical SMILES for 6-[(3-methylimidazo[1,5-a]pyridin-1-yl)methyl]-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine is Cc1nc(CN2CCc3nc(-c4ccccc4)ncc3C2)c2ccccn12.
What is the InChIKey of 6-[(3-methylimidazo[1,5-a]pyridin-1-yl)methyl]-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine?
The InChIKey is ZOEVWHGEUNFMLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N5/c1-16-24-20(21-9-5-6-11-27(16)21)15-26-12-10-19-18(14-26)13-23-22(25-19)17-7-3-2-4-8-17/h2-9,11,13H,10,12,14-15H2,1H3.
What are the key properties of 6-[(3-methylimidazo[1,5-a]pyridin-1-yl)methyl]-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine?
6-[(3-methylimidazo[1,5-a]pyridin-1-yl)methyl]-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine has a molecular weight of 355.45 g/mol, XLogP of 3.66, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(3-methylimidazo[1,5-a]pyridin-1-yl)methyl]-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine is sourced from PubChem (CID 24915169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).