4-(6-methoxy-3-pyridinyl)-2-(6-methyl-2-pyridinyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine

C19H18N4O — CID 71276522

IUPAC4-(6-methoxy-3-pyridinyl)-2-(6-methyl-2-pyridinyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine
SMILESCOc1ccc(-c2nc(-c3cccc(C)n3)nc3c2CCC3)cn1
InChIInChI=1S/C19H18N4O/c1-12-5-3-8-16(21-12)19-22-15-7-4-6-14(15)18(23-19)13-9-10-17(24-2)20-11-13/h3,5,8-11H,4,6-7H2,1-2H3
InChIKeyNHWVAXZMSYFWHV-UHFFFAOYSA-N
MW318.38 g/mol
LogP3.41
Rot. Bonds3

About 4-(6-methoxy-3-pyridinyl)-2-(6-methyl-2-pyridinyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine

4-(6-methoxy-3-pyridinyl)-2-(6-methyl-2-pyridinyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine (PubChem CID 71276522) has the molecular formula C19H18N4O and a molecular weight of 318.38 g/mol. Its IUPAC name is 4-(6-methoxy-3-pyridinyl)-2-(6-methyl-2-pyridinyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine.

Molecular Properties

Compound Name4-(6-methoxy-3-pyridinyl)-2-(6-methyl-2-pyridinyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine
PubChem CID71276522
Molecular FormulaC19H18N4O
Molecular Weight318.38 g/mol
Exact Mass318.15
IUPAC Name4-(6-methoxy-3-pyridinyl)-2-(6-methyl-2-pyridinyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine
SMILESCOc1ccc(-c2nc(-c3cccc(C)n3)nc3c2CCC3)cn1
InChIInChI=1S/C19H18N4O/c1-12-5-3-8-16(21-12)19-22-15-7-4-6-14(15)18(23-19)13-9-10-17(24-2)20-11-13/h3,5,8-11H,4,6-7H2,1-2H3
InChIKeyNHWVAXZMSYFWHV-UHFFFAOYSA-N
XLogP3.41
TPSA60.79 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.38
LogP ≤ 53.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 4-(6-methoxy-3-pyridinyl)-2-(6-methyl-2-pyridinyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(6-methoxy-3-pyridinyl)-2-(6-methyl-2-pyridinyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine?
The IUPAC name of 4-(6-methoxy-3-pyridinyl)-2-(6-methyl-2-pyridinyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine (CID 71276522) is 4-(6-methoxy-3-pyridinyl)-2-(6-methyl-2-pyridinyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine.
What is the SMILES notation for 4-(6-methoxy-3-pyridinyl)-2-(6-methyl-2-pyridinyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine?
The canonical SMILES for 4-(6-methoxy-3-pyridinyl)-2-(6-methyl-2-pyridinyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine is COc1ccc(-c2nc(-c3cccc(C)n3)nc3c2CCC3)cn1.
What is the InChIKey of 4-(6-methoxy-3-pyridinyl)-2-(6-methyl-2-pyridinyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine?
The InChIKey is NHWVAXZMSYFWHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O/c1-12-5-3-8-16(21-12)19-22-15-7-4-6-14(15)18(23-19)13-9-10-17(24-2)20-11-13/h3,5,8-11H,4,6-7H2,1-2H3.
What are the key properties of 4-(6-methoxy-3-pyridinyl)-2-(6-methyl-2-pyridinyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine?
4-(6-methoxy-3-pyridinyl)-2-(6-methyl-2-pyridinyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine has a molecular weight of 318.38 g/mol, XLogP of 3.41, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-methoxy-3-pyridinyl)-2-(6-methyl-2-pyridinyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine is sourced from PubChem (CID 71276522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).