6-(4-methoxy-6-methyl-2-pyridinyl)-5-methyl-2-(1H-pyrazol-5-yl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine

C18H20N6O — CID 142340822

IUPAC6-(4-methoxy-6-methyl-2-pyridinyl)-5-methyl-2-(1H-pyrazol-5-yl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
SMILESCOc1cc(C)nc(N2CCc3nc(-c4ccn[nH]4)ncc3C2C)c1
InChIInChI=1S/C18H20N6O/c1-11-8-13(25-3)9-17(21-11)24-7-5-15-14(12(24)2)10-19-18(22-15)16-4-6-20-23-16/h4,6,8-10,12H,5,7H2,1-3H3,(H,20,23)
InChIKeyAMGPMUQANLZHRB-UHFFFAOYSA-N
MW336.40 g/mol
LogP2.70
Rot. Bonds3

About 6-(4-methoxy-6-methyl-2-pyridinyl)-5-methyl-2-(1H-pyrazol-5-yl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine

6-(4-methoxy-6-methyl-2-pyridinyl)-5-methyl-2-(1H-pyrazol-5-yl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine (PubChem CID 142340822) has the molecular formula C18H20N6O and a molecular weight of 336.40 g/mol. Its IUPAC name is 6-(4-methoxy-6-methyl-2-pyridinyl)-5-methyl-2-(1H-pyrazol-5-yl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine.

Molecular Properties

Compound Name6-(4-methoxy-6-methyl-2-pyridinyl)-5-methyl-2-(1H-pyrazol-5-yl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
PubChem CID142340822
Molecular FormulaC18H20N6O
Molecular Weight336.40 g/mol
Exact Mass336.17
IUPAC Name6-(4-methoxy-6-methyl-2-pyridinyl)-5-methyl-2-(1H-pyrazol-5-yl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
SMILESCOc1cc(C)nc(N2CCc3nc(-c4ccn[nH]4)ncc3C2C)c1
InChIInChI=1S/C18H20N6O/c1-11-8-13(25-3)9-17(21-11)24-7-5-15-14(12(24)2)10-19-18(22-15)16-4-6-20-23-16/h4,6,8-10,12H,5,7H2,1-3H3,(H,20,23)
InChIKeyAMGPMUQANLZHRB-UHFFFAOYSA-N
XLogP2.70
TPSA79.82 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.40
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-(4-methoxy-6-methyl-2-pyridinyl)-5-methyl-2-(1H-pyrazol-5-yl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine?
The IUPAC name of 6-(4-methoxy-6-methyl-2-pyridinyl)-5-methyl-2-(1H-pyrazol-5-yl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine (CID 142340822) is 6-(4-methoxy-6-methyl-2-pyridinyl)-5-methyl-2-(1H-pyrazol-5-yl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine.
What is the SMILES notation for 6-(4-methoxy-6-methyl-2-pyridinyl)-5-methyl-2-(1H-pyrazol-5-yl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine?
The canonical SMILES for 6-(4-methoxy-6-methyl-2-pyridinyl)-5-methyl-2-(1H-pyrazol-5-yl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine is COc1cc(C)nc(N2CCc3nc(-c4ccn[nH]4)ncc3C2C)c1.
What is the InChIKey of 6-(4-methoxy-6-methyl-2-pyridinyl)-5-methyl-2-(1H-pyrazol-5-yl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine?
The InChIKey is AMGPMUQANLZHRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N6O/c1-11-8-13(25-3)9-17(21-11)24-7-5-15-14(12(24)2)10-19-18(22-15)16-4-6-20-23-16/h4,6,8-10,12H,5,7H2,1-3H3,(H,20,23).
What are the key properties of 6-(4-methoxy-6-methyl-2-pyridinyl)-5-methyl-2-(1H-pyrazol-5-yl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine?
6-(4-methoxy-6-methyl-2-pyridinyl)-5-methyl-2-(1H-pyrazol-5-yl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine has a molecular weight of 336.40 g/mol, XLogP of 2.70, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-methoxy-6-methyl-2-pyridinyl)-5-methyl-2-(1H-pyrazol-5-yl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine is sourced from PubChem (CID 142340822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).