3-(6,7-dimethoxy-4-oxoquinazolin-3-yl)-N-(2-morpholin-4-ylethyl)propanamide

C19H26N4O5 — CID 45493036

IUPAC3-(6,7-dimethoxy-4-oxoquinazolin-3-yl)-N-(2-morpholin-4-ylethyl)propanamide
SMILESCOc1cc2ncn(CCC(=O)NCCN3CCOCC3)c(=O)c2cc1OC
InChIInChI=1S/C19H26N4O5/c1-26-16-11-14-15(12-17(16)27-2)21-13-23(19(14)25)5-3-18(24)20-4-6-22-7-9-28-10-8-22/h11-13H,3-10H2,1-2H3,(H,20,24)
InChIKeyFCPNPDNRPAFTGV-UHFFFAOYSA-N
MW390.44 g/mol
LogP0.25
Rot. Bonds8

About 3-(6,7-dimethoxy-4-oxoquinazolin-3-yl)-N-(2-morpholin-4-ylethyl)propanamide

3-(6,7-dimethoxy-4-oxoquinazolin-3-yl)-N-(2-morpholin-4-ylethyl)propanamide (PubChem CID 45493036) has the molecular formula C19H26N4O5 and a molecular weight of 390.44 g/mol. Its IUPAC name is 3-(6,7-dimethoxy-4-oxoquinazolin-3-yl)-N-(2-morpholin-4-ylethyl)propanamide.

Molecular Properties

Compound Name3-(6,7-dimethoxy-4-oxoquinazolin-3-yl)-N-(2-morpholin-4-ylethyl)propanamide
PubChem CID45493036
Molecular FormulaC19H26N4O5
Molecular Weight390.44 g/mol
Exact Mass390.19
IUPAC Name3-(6,7-dimethoxy-4-oxoquinazolin-3-yl)-N-(2-morpholin-4-ylethyl)propanamide
SMILESCOc1cc2ncn(CCC(=O)NCCN3CCOCC3)c(=O)c2cc1OC
InChIInChI=1S/C19H26N4O5/c1-26-16-11-14-15(12-17(16)27-2)21-13-23(19(14)25)5-3-18(24)20-4-6-22-7-9-28-10-8-22/h11-13H,3-10H2,1-2H3,(H,20,24)
InChIKeyFCPNPDNRPAFTGV-UHFFFAOYSA-N
XLogP0.25
TPSA94.92 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.44
LogP ≤ 50.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze 3-(6,7-dimethoxy-4-oxoquinazolin-3-yl)-N-(2-morpholin-4-ylethyl)propanamide with MolForge

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Related Compounds

N-[2-(4-benzylpiperazin-1-yl)ethyl]-4-(6,7-dimethoxy-4-oxoquinazolin-3-yl)butanamide
CID 55522180
3-(6,7-dimethoxy-4-oxoquinazolin-3-yl)-N-[2-(4-methoxyphenyl)ethyl]propanamide
CID 39378134
3-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-morpholin-4-ylethyl)propanamide
CID 39394609
methyl (2S)-2-[3-(6,7-dimethoxy-4-oxoquinazolin-3-yl)propanoylamino]-4-methylpentanoate
CID 45490464
4-(6,7-dimethoxy-4-oxoquinazolin-3-yl)-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]butanamide
CID 55455013
N-[[(1R,2R,4S)-2-bicyclo[2.2.1]hept-5-enyl]methyl]-3-(6,7-dimethoxy-4-oxoquinazolin-3-yl)propanamide
CID 98226210
4-(6,7-dimethoxy-4-oxoquinazolin-3-yl)-N-(2,2,2-trifluoroethyl)butanamide
CID 51276831
methyl 4-[3-(6,7-dimethoxy-4-oxoquinazolin-3-yl)propanoylamino]benzoate
CID 39377823
4-(6,7-dimethoxy-4-oxoquinazolin-3-yl)-N-[2-(2-methylphenoxy)ethyl]butanamide
CID 55908483
N-[2-(4-tert-butylphenyl)ethyl]-4-(6,7-dimethoxy-4-oxoquinazolin-3-yl)butanamide
CID 46442118
4-(6,7-dimethoxy-4-oxoquinazolin-3-yl)-N-[1-[2-oxo-2-(propylamino)ethyl]piperidin-4-yl]butanamide
CID 55658444
4-[3-(6,7-dimethoxy-4-oxoquinazolin-3-yl)propanoylamino]benzamide
CID 39377637

Frequently Asked Questions

What is the IUPAC name of 3-(6,7-dimethoxy-4-oxoquinazolin-3-yl)-N-(2-morpholin-4-ylethyl)propanamide?
The IUPAC name of 3-(6,7-dimethoxy-4-oxoquinazolin-3-yl)-N-(2-morpholin-4-ylethyl)propanamide (CID 45493036) is 3-(6,7-dimethoxy-4-oxoquinazolin-3-yl)-N-(2-morpholin-4-ylethyl)propanamide.
What is the SMILES notation for 3-(6,7-dimethoxy-4-oxoquinazolin-3-yl)-N-(2-morpholin-4-ylethyl)propanamide?
The canonical SMILES for 3-(6,7-dimethoxy-4-oxoquinazolin-3-yl)-N-(2-morpholin-4-ylethyl)propanamide is COc1cc2ncn(CCC(=O)NCCN3CCOCC3)c(=O)c2cc1OC.
What is the InChIKey of 3-(6,7-dimethoxy-4-oxoquinazolin-3-yl)-N-(2-morpholin-4-ylethyl)propanamide?
The InChIKey is FCPNPDNRPAFTGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O5/c1-26-16-11-14-15(12-17(16)27-2)21-13-23(19(14)25)5-3-18(24)20-4-6-22-7-9-28-10-8-22/h11-13H,3-10H2,1-2H3,(H,20,24).
What are the key properties of 3-(6,7-dimethoxy-4-oxoquinazolin-3-yl)-N-(2-morpholin-4-ylethyl)propanamide?
3-(6,7-dimethoxy-4-oxoquinazolin-3-yl)-N-(2-morpholin-4-ylethyl)propanamide has a molecular weight of 390.44 g/mol, XLogP of 0.25, 8 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6,7-dimethoxy-4-oxoquinazolin-3-yl)-N-(2-morpholin-4-ylethyl)propanamide is sourced from PubChem (CID 45493036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).