2-(8-methyl-4-oxoquinazolin-3-yl)-N-[2-(2-methyl-3-pyridinyl)ethyl]acetamide

C19H20N4O2 — CID 136567983

IUPAC2-(8-methyl-4-oxoquinazolin-3-yl)-N-[2-(2-methyl-3-pyridinyl)ethyl]acetamide
SMILESCc1ncccc1CCNC(=O)Cn1cnc2c(C)cccc2c1=O
InChIInChI=1S/C19H20N4O2/c1-13-5-3-7-16-18(13)22-12-23(19(16)25)11-17(24)21-10-8-15-6-4-9-20-14(15)2/h3-7,9,12H,8,10-11H2,1-2H3,(H,21,24)
InChIKeyUCXOUNAZKVKTQM-UHFFFAOYSA-N
MW336.40 g/mol
LogP1.77
Rot. Bonds5

About 2-(8-methyl-4-oxoquinazolin-3-yl)-N-[2-(2-methyl-3-pyridinyl)ethyl]acetamide

2-(8-methyl-4-oxoquinazolin-3-yl)-N-[2-(2-methyl-3-pyridinyl)ethyl]acetamide (PubChem CID 136567983) has the molecular formula C19H20N4O2 and a molecular weight of 336.40 g/mol. Its IUPAC name is 2-(8-methyl-4-oxoquinazolin-3-yl)-N-[2-(2-methyl-3-pyridinyl)ethyl]acetamide.

Molecular Properties

Compound Name2-(8-methyl-4-oxoquinazolin-3-yl)-N-[2-(2-methyl-3-pyridinyl)ethyl]acetamide
PubChem CID136567983
Molecular FormulaC19H20N4O2
Molecular Weight336.40 g/mol
Exact Mass336.16
IUPAC Name2-(8-methyl-4-oxoquinazolin-3-yl)-N-[2-(2-methyl-3-pyridinyl)ethyl]acetamide
SMILESCc1ncccc1CCNC(=O)Cn1cnc2c(C)cccc2c1=O
InChIInChI=1S/C19H20N4O2/c1-13-5-3-7-16-18(13)22-12-23(19(16)25)11-17(24)21-10-8-15-6-4-9-20-14(15)2/h3-7,9,12H,8,10-11H2,1-2H3,(H,21,24)
InChIKeyUCXOUNAZKVKTQM-UHFFFAOYSA-N
XLogP1.77
TPSA76.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.40
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(8-methyl-4-oxoquinazolin-3-yl)-N-[2-(2-methyl-3-pyridinyl)ethyl]acetamide?
The IUPAC name of 2-(8-methyl-4-oxoquinazolin-3-yl)-N-[2-(2-methyl-3-pyridinyl)ethyl]acetamide (CID 136567983) is 2-(8-methyl-4-oxoquinazolin-3-yl)-N-[2-(2-methyl-3-pyridinyl)ethyl]acetamide.
What is the SMILES notation for 2-(8-methyl-4-oxoquinazolin-3-yl)-N-[2-(2-methyl-3-pyridinyl)ethyl]acetamide?
The canonical SMILES for 2-(8-methyl-4-oxoquinazolin-3-yl)-N-[2-(2-methyl-3-pyridinyl)ethyl]acetamide is Cc1ncccc1CCNC(=O)Cn1cnc2c(C)cccc2c1=O.
What is the InChIKey of 2-(8-methyl-4-oxoquinazolin-3-yl)-N-[2-(2-methyl-3-pyridinyl)ethyl]acetamide?
The InChIKey is UCXOUNAZKVKTQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O2/c1-13-5-3-7-16-18(13)22-12-23(19(16)25)11-17(24)21-10-8-15-6-4-9-20-14(15)2/h3-7,9,12H,8,10-11H2,1-2H3,(H,21,24).
What are the key properties of 2-(8-methyl-4-oxoquinazolin-3-yl)-N-[2-(2-methyl-3-pyridinyl)ethyl]acetamide?
2-(8-methyl-4-oxoquinazolin-3-yl)-N-[2-(2-methyl-3-pyridinyl)ethyl]acetamide has a molecular weight of 336.40 g/mol, XLogP of 1.77, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(8-methyl-4-oxoquinazolin-3-yl)-N-[2-(2-methyl-3-pyridinyl)ethyl]acetamide is sourced from PubChem (CID 136567983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).