3-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-morpholin-4-ylethyl)propanamide

C18H24N4O3 — CID 39394609

IUPAC3-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-morpholin-4-ylethyl)propanamide
SMILESCc1cccc2c(=O)n(CCC(=O)NCCN3CCOCC3)cnc12
InChIInChI=1S/C18H24N4O3/c1-14-3-2-4-15-17(14)20-13-22(18(15)24)7-5-16(23)19-6-8-21-9-11-25-12-10-21/h2-4,13H,5-12H2,1H3,(H,19,23)
InChIKeyBEBXQKLAYXQDJM-UHFFFAOYSA-N
MW344.41 g/mol
LogP0.54
Rot. Bonds6

About 3-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-morpholin-4-ylethyl)propanamide

3-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-morpholin-4-ylethyl)propanamide (PubChem CID 39394609) has the molecular formula C18H24N4O3 and a molecular weight of 344.41 g/mol. Its IUPAC name is 3-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-morpholin-4-ylethyl)propanamide.

Molecular Properties

Compound Name3-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-morpholin-4-ylethyl)propanamide
PubChem CID39394609
Molecular FormulaC18H24N4O3
Molecular Weight344.41 g/mol
Exact Mass344.18
IUPAC Name3-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-morpholin-4-ylethyl)propanamide
SMILESCc1cccc2c(=O)n(CCC(=O)NCCN3CCOCC3)cnc12
InChIInChI=1S/C18H24N4O3/c1-14-3-2-4-15-17(14)20-13-22(18(15)24)7-5-16(23)19-6-8-21-9-11-25-12-10-21/h2-4,13H,5-12H2,1H3,(H,19,23)
InChIKeyBEBXQKLAYXQDJM-UHFFFAOYSA-N
XLogP0.54
TPSA76.46 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.41
LogP ≤ 50.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-piperazin-1-ylethyl)propanamide;hydrochloride
CID 119446827
3-(8-methyl-4-oxoquinazolin-3-yl)-N-(3-oxo-3-pyrrolidin-1-ylpropyl)propanamide
CID 51272641
3-(8-methyl-4-oxoquinazolin-3-yl)-N-[4-[4-(3-methylphenyl)piperazin-1-yl]butyl]propanamide
CID 39303958
N-[2-(4-ethoxyphenoxy)ethyl]-3-(8-methyl-4-oxoquinazolin-3-yl)propanamide
CID 24559975
3-(6,7-dimethoxy-4-oxoquinazolin-3-yl)-N-(2-morpholin-4-ylethyl)propanamide
CID 45493036
N-[3-[4-(dimethylamino)phenyl]propyl]-3-(8-methyl-4-oxoquinazolin-3-yl)propanamide
CID 55619017
3-(8-methyl-4-oxoquinazolin-3-yl)-N-(3-phenylmethoxypropyl)propanamide
CID 24682780
N-[(4-fluoro-3-methylphenyl)methyl]-3-(8-methyl-4-oxoquinazolin-3-yl)propanamide
CID 26053992
N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-3-(8-methyl-4-oxoquinazolin-3-yl)propanamide
CID 34454596
2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-morpholin-4-yl-1-phenylethyl)acetamide
CID 24532776
8-methoxy-3-(2-morpholin-4-ylethyl)quinazolin-4-one
CID 39782631
2-(2,6-dimethylphenoxy)-N-(2-morpholin-4-ylethyl)acetamide
CID 18892490

Frequently Asked Questions

What is the IUPAC name of 3-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-morpholin-4-ylethyl)propanamide?
The IUPAC name of 3-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-morpholin-4-ylethyl)propanamide (CID 39394609) is 3-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-morpholin-4-ylethyl)propanamide.
What is the SMILES notation for 3-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-morpholin-4-ylethyl)propanamide?
The canonical SMILES for 3-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-morpholin-4-ylethyl)propanamide is Cc1cccc2c(=O)n(CCC(=O)NCCN3CCOCC3)cnc12.
What is the InChIKey of 3-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-morpholin-4-ylethyl)propanamide?
The InChIKey is BEBXQKLAYXQDJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O3/c1-14-3-2-4-15-17(14)20-13-22(18(15)24)7-5-16(23)19-6-8-21-9-11-25-12-10-21/h2-4,13H,5-12H2,1H3,(H,19,23).
What are the key properties of 3-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-morpholin-4-ylethyl)propanamide?
3-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-morpholin-4-ylethyl)propanamide has a molecular weight of 344.41 g/mol, XLogP of 0.54, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-morpholin-4-ylethyl)propanamide is sourced from PubChem (CID 39394609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).