6-[3-ethyl-1-(6-methyl-2-pyridinyl)pyrazol-5-yl]-3-methylquinazolin-4-one

C20H19N5O — CID 70683591

IUPAC6-[3-ethyl-1-(6-methyl-2-pyridinyl)pyrazol-5-yl]-3-methylquinazolin-4-one
SMILESCCc1cc(-c2ccc3ncn(C)c(=O)c3c2)n(-c2cccc(C)n2)n1
InChIInChI=1S/C20H19N5O/c1-4-15-11-18(25(23-15)19-7-5-6-13(2)22-19)14-8-9-17-16(10-14)20(26)24(3)12-21-17/h5-12H,4H2,1-3H3
InChIKeyVJMHEUYXAZSMMN-UHFFFAOYSA-N
MW345.41 g/mol
LogP3.05
Rot. Bonds3

About 6-[3-ethyl-1-(6-methyl-2-pyridinyl)pyrazol-5-yl]-3-methylquinazolin-4-one

6-[3-ethyl-1-(6-methyl-2-pyridinyl)pyrazol-5-yl]-3-methylquinazolin-4-one (PubChem CID 70683591) has the molecular formula C20H19N5O and a molecular weight of 345.41 g/mol. Its IUPAC name is 6-[3-ethyl-1-(6-methyl-2-pyridinyl)pyrazol-5-yl]-3-methylquinazolin-4-one.

Molecular Properties

Compound Name6-[3-ethyl-1-(6-methyl-2-pyridinyl)pyrazol-5-yl]-3-methylquinazolin-4-one
PubChem CID70683591
Molecular FormulaC20H19N5O
Molecular Weight345.41 g/mol
Exact Mass345.16
IUPAC Name6-[3-ethyl-1-(6-methyl-2-pyridinyl)pyrazol-5-yl]-3-methylquinazolin-4-one
SMILESCCc1cc(-c2ccc3ncn(C)c(=O)c3c2)n(-c2cccc(C)n2)n1
InChIInChI=1S/C20H19N5O/c1-4-15-11-18(25(23-15)19-7-5-6-13(2)22-19)14-8-9-17-16(10-14)20(26)24(3)12-21-17/h5-12H,4H2,1-3H3
InChIKeyVJMHEUYXAZSMMN-UHFFFAOYSA-N
XLogP3.05
TPSA65.60 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.41
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

6-(4-amino-1-isopropyl-1H-pyrazolo[3,4-d]pyrimidin-3-yl)quinazolin-4(3H)-one
CID 135947976
6-[4-methyl-1-(6-methyl-2-pyridinyl)pyrazol-5-yl]-3H-quinazolin-4-one
CID 136254194
3-Methyl-6-[2-(6-methyl-2-pyridinyl)pyrazol-3-yl]quinazolin-4-one
CID 66561650
6-[2-(6-methyl-2-pyridinyl)pyrazol-3-yl]-3H-quinazolin-4-one
CID 136254195
[4-(3,5-dimethylpyrazolyl)phenyl]-N-(2-pyridyl)carboxamide
CID 663966
[4-(3,5-Dimethylpyrazol-1-yl)phenyl]-(4-pyridin-2-ylpiperazin-1-yl)methanone
CID 8934323
3-Ethyl-6-[2-(6-methyl-2-pyridinyl)pyrazol-3-yl]quinazolin-4-one
CID 70681473
3-Ethenyl-6-[2-(6-methyl-2-pyridinyl)pyrazol-3-yl]quinazolin-4-one
CID 70687848
3-Methyl-6-[4-methyl-1-(6-methyl-2-pyridinyl)pyrazol-5-yl]quinazolin-4-one
CID 70687849
3-Methyl-6-[5-methyl-2-(6-methyl-2-pyridinyl)pyrazol-3-yl]quinazolin-4-one
CID 70692041
5-[4-(dimethylamino)phenyl]-1,4-dimethyl-N-(6-methyl-2-pyridinyl)pyrazole-3-carboxamide
CID 71579930
2-(3-(4-methylpiperazine-1-carbonyl)phenyl)pyrazolo[1,5-a]quinazolin-5(4H)-one
CID 135965881

Frequently Asked Questions

What is the IUPAC name of 6-[3-ethyl-1-(6-methyl-2-pyridinyl)pyrazol-5-yl]-3-methylquinazolin-4-one?
The IUPAC name of 6-[3-ethyl-1-(6-methyl-2-pyridinyl)pyrazol-5-yl]-3-methylquinazolin-4-one (CID 70683591) is 6-[3-ethyl-1-(6-methyl-2-pyridinyl)pyrazol-5-yl]-3-methylquinazolin-4-one.
What is the SMILES notation for 6-[3-ethyl-1-(6-methyl-2-pyridinyl)pyrazol-5-yl]-3-methylquinazolin-4-one?
The canonical SMILES for 6-[3-ethyl-1-(6-methyl-2-pyridinyl)pyrazol-5-yl]-3-methylquinazolin-4-one is CCc1cc(-c2ccc3ncn(C)c(=O)c3c2)n(-c2cccc(C)n2)n1.
What is the InChIKey of 6-[3-ethyl-1-(6-methyl-2-pyridinyl)pyrazol-5-yl]-3-methylquinazolin-4-one?
The InChIKey is VJMHEUYXAZSMMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N5O/c1-4-15-11-18(25(23-15)19-7-5-6-13(2)22-19)14-8-9-17-16(10-14)20(26)24(3)12-21-17/h5-12H,4H2,1-3H3.
What are the key properties of 6-[3-ethyl-1-(6-methyl-2-pyridinyl)pyrazol-5-yl]-3-methylquinazolin-4-one?
6-[3-ethyl-1-(6-methyl-2-pyridinyl)pyrazol-5-yl]-3-methylquinazolin-4-one has a molecular weight of 345.41 g/mol, XLogP of 3.05, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[3-ethyl-1-(6-methyl-2-pyridinyl)pyrazol-5-yl]-3-methylquinazolin-4-one is sourced from PubChem (CID 70683591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).