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

C17H21N5 — CID 95145907

IUPAC6-methyl-4-[(2R)-2-pyridin-2-ylpyrrolidin-1-yl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
SMILESCN1CCc2ncnc(N3CCC[C@@H]3c3ccccn3)c2C1
InChIInChI=1S/C17H21N5/c1-21-10-7-14-13(11-21)17(20-12-19-14)22-9-4-6-16(22)15-5-2-3-8-18-15/h2-3,5,8,12,16H,4,6-7,9-11H2,1H3/t16-/m1/s1
InChIKeyNVALRYNNZCFLKV-MRXNPFEDSA-N
MW295.39 g/mol
LogP2.20
Rot. Bonds2

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

6-methyl-4-[(2R)-2-pyridin-2-ylpyrrolidin-1-yl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine (PubChem CID 95145907) has the molecular formula C17H21N5 and a molecular weight of 295.39 g/mol. Its IUPAC name is 6-methyl-4-[(2R)-2-pyridin-2-ylpyrrolidin-1-yl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine.

Molecular Properties

Compound Name6-methyl-4-[(2R)-2-pyridin-2-ylpyrrolidin-1-yl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
PubChem CID95145907
Molecular FormulaC17H21N5
Molecular Weight295.39 g/mol
Exact Mass295.18
IUPAC Name6-methyl-4-[(2R)-2-pyridin-2-ylpyrrolidin-1-yl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
SMILESCN1CCc2ncnc(N3CCC[C@@H]3c3ccccn3)c2C1
InChIInChI=1S/C17H21N5/c1-21-10-7-14-13(11-21)17(20-12-19-14)22-9-4-6-16(22)15-5-2-3-8-18-15/h2-3,5,8,12,16H,4,6-7,9-11H2,1H3/t16-/m1/s1
InChIKeyNVALRYNNZCFLKV-MRXNPFEDSA-N
XLogP2.20
TPSA45.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.39
LogP ≤ 52.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 6-methyl-4-[(2R)-2-pyridin-2-ylpyrrolidin-1-yl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine with MolForge

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Related Compounds

4-[(2S)-2-(4-fluorophenyl)pyrrolidin-1-yl]-6-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 129427639
4-[(3aR,7aR)-2,3,3a,4,5,6,7,7a-octahydroindol-1-yl]-6-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 129418475
4-[(3aR,6aR)-1-phenyl-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrol-5-yl]-6-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 129418440
(5-methyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl)-(2-pyridin-2-ylpyrrolidin-1-yl)methanone
CID 56875753
1-phenyl-4-[(2S)-2-pyridin-2-ylpyrrolidin-1-yl]pyrazolo[5,4-d]pyrimidine
CID 94664592
2-[(2R)-2-pyridin-2-ylpyrrolidin-1-yl]pyridine-3-carboxylic acid
CID 40637940
(2R)-4-(6-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)-2-phenylmorpholine
CID 95138636
4-[4-(6-methoxy-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)piperidin-1-yl]-6-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 126911734
(3S,5S)-5-(3-fluorophenyl)-1-(6-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)pyrrolidin-3-ol
CID 129480731
5-(3-fluorophenyl)-1-(6-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)pyrrolidin-3-ol
CID 128970090
[(3S)-1-(6-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)piperidin-3-yl]-piperidin-1-ylmethanone
CID 95138634
2-phenyl-4-[(2S)-2-pyridin-2-ylpyrrolidin-1-yl]pyrimidine
CID 95298088

Frequently Asked Questions

What is the IUPAC name of 6-methyl-4-[(2R)-2-pyridin-2-ylpyrrolidin-1-yl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine?
The IUPAC name of 6-methyl-4-[(2R)-2-pyridin-2-ylpyrrolidin-1-yl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine (CID 95145907) is 6-methyl-4-[(2R)-2-pyridin-2-ylpyrrolidin-1-yl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine.
What is the SMILES notation for 6-methyl-4-[(2R)-2-pyridin-2-ylpyrrolidin-1-yl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine?
The canonical SMILES for 6-methyl-4-[(2R)-2-pyridin-2-ylpyrrolidin-1-yl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine is CN1CCc2ncnc(N3CCC[C@@H]3c3ccccn3)c2C1.
What is the InChIKey of 6-methyl-4-[(2R)-2-pyridin-2-ylpyrrolidin-1-yl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine?
The InChIKey is NVALRYNNZCFLKV-MRXNPFEDSA-N. The full InChI is InChI=1S/C17H21N5/c1-21-10-7-14-13(11-21)17(20-12-19-14)22-9-4-6-16(22)15-5-2-3-8-18-15/h2-3,5,8,12,16H,4,6-7,9-11H2,1H3/t16-/m1/s1.
What are the key properties of 6-methyl-4-[(2R)-2-pyridin-2-ylpyrrolidin-1-yl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine?
6-methyl-4-[(2R)-2-pyridin-2-ylpyrrolidin-1-yl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine has a molecular weight of 295.39 g/mol, XLogP of 2.20, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-4-[(2R)-2-pyridin-2-ylpyrrolidin-1-yl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine is sourced from PubChem (CID 95145907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).