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

C22H19FN6 — CID 24917818

IUPAC6-[[5-(4-fluorophenyl)-1H-imidazol-2-yl]methyl]-2-pyridin-3-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
SMILESFc1ccc(-c2cnc(CN3CCc4nc(-c5cccnc5)ncc4C3)[nH]2)cc1
InChIInChI=1S/C22H19FN6/c23-18-5-3-15(4-6-18)20-12-25-21(27-20)14-29-9-7-19-17(13-29)11-26-22(28-19)16-2-1-8-24-10-16/h1-6,8,10-12H,7,9,13-14H2,(H,25,27)
InChIKeyFAIDQCHPJNVETI-UHFFFAOYSA-N
MW386.43 g/mol
LogP3.63
Rot. Bonds4

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

6-[[5-(4-fluorophenyl)-1H-imidazol-2-yl]methyl]-2-pyridin-3-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine (PubChem CID 24917818) has the molecular formula C22H19FN6 and a molecular weight of 386.43 g/mol. Its IUPAC name is 6-[[5-(4-fluorophenyl)-1H-imidazol-2-yl]methyl]-2-pyridin-3-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine.

Molecular Properties

Compound Name6-[[5-(4-fluorophenyl)-1H-imidazol-2-yl]methyl]-2-pyridin-3-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
PubChem CID24917818
Molecular FormulaC22H19FN6
Molecular Weight386.43 g/mol
Exact Mass386.17
IUPAC Name6-[[5-(4-fluorophenyl)-1H-imidazol-2-yl]methyl]-2-pyridin-3-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
SMILESFc1ccc(-c2cnc(CN3CCc4nc(-c5cccnc5)ncc4C3)[nH]2)cc1
InChIInChI=1S/C22H19FN6/c23-18-5-3-15(4-6-18)20-12-25-21(27-20)14-29-9-7-19-17(13-29)11-26-22(28-19)16-2-1-8-24-10-16/h1-6,8,10-12H,7,9,13-14H2,(H,25,27)
InChIKeyFAIDQCHPJNVETI-UHFFFAOYSA-N
XLogP3.63
TPSA70.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.43
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-[[6-(4-fluorophenyl)-3-pyridinyl]methyl]-2-pyridin-3-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 24914228
6-[(6-fluoro-1H-indol-3-yl)methyl]-2-pyridin-3-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 24909566
6-[(2-chloro-5-fluoro-3-pyridinyl)methyl]-2-pyridin-3-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 24913073
6-[(3,5-dibromo-4-pyridinyl)methyl]-2-pyridin-3-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 24915740
6-(1H-indol-2-ylmethyl)-2-pyridin-3-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 24912905
6-[[1-(4-fluorophenyl)-3-methylpyrazol-4-yl]methyl]-2-pyridin-3-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 24915383
6-[(3-bromo-4-pyridinyl)methyl]-2-pyridin-3-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 24915026
2-pyridin-3-yl-6-[[4-(trifluoromethyl)-3-pyridinyl]methyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 24917293
2-pyridin-3-yl-6-(1H-pyrrolo[2,3-b]pyridin-3-ylmethyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 24913283
2-pyridin-3-yl-6-(quinolin-4-ylmethyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 24908960
6-[(5-chlorothiophen-2-yl)methyl]-2-pyridin-3-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 24909314
6-[(1-benzylpyrazol-4-yl)methyl]-2-pyridin-3-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 24912212

Frequently Asked Questions

What is the IUPAC name of 6-[[5-(4-fluorophenyl)-1H-imidazol-2-yl]methyl]-2-pyridin-3-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine?
The IUPAC name of 6-[[5-(4-fluorophenyl)-1H-imidazol-2-yl]methyl]-2-pyridin-3-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine (CID 24917818) is 6-[[5-(4-fluorophenyl)-1H-imidazol-2-yl]methyl]-2-pyridin-3-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine.
What is the SMILES notation for 6-[[5-(4-fluorophenyl)-1H-imidazol-2-yl]methyl]-2-pyridin-3-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine?
The canonical SMILES for 6-[[5-(4-fluorophenyl)-1H-imidazol-2-yl]methyl]-2-pyridin-3-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine is Fc1ccc(-c2cnc(CN3CCc4nc(-c5cccnc5)ncc4C3)[nH]2)cc1.
What is the InChIKey of 6-[[5-(4-fluorophenyl)-1H-imidazol-2-yl]methyl]-2-pyridin-3-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine?
The InChIKey is FAIDQCHPJNVETI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19FN6/c23-18-5-3-15(4-6-18)20-12-25-21(27-20)14-29-9-7-19-17(13-29)11-26-22(28-19)16-2-1-8-24-10-16/h1-6,8,10-12H,7,9,13-14H2,(H,25,27).
What are the key properties of 6-[[5-(4-fluorophenyl)-1H-imidazol-2-yl]methyl]-2-pyridin-3-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine?
6-[[5-(4-fluorophenyl)-1H-imidazol-2-yl]methyl]-2-pyridin-3-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine has a molecular weight of 386.43 g/mol, XLogP of 3.63, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[5-(4-fluorophenyl)-1H-imidazol-2-yl]methyl]-2-pyridin-3-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine is sourced from PubChem (CID 24917818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).