2-(4-propylmorpholin-2-yl)-7,8-dihydro-6H-quinazolin-5-one

C15H21N3O2 — CID 79658032

IUPAC2-(4-propylmorpholin-2-yl)-7,8-dihydro-6H-quinazolin-5-one
SMILESCCCN1CCOC(c2ncc3c(n2)CCCC3=O)C1
InChIInChI=1S/C15H21N3O2/c1-2-6-18-7-8-20-14(10-18)15-16-9-11-12(17-15)4-3-5-13(11)19/h9,14H,2-8,10H2,1H3
InChIKeyRPGDLPGITVSCGN-UHFFFAOYSA-N
MW275.35 g/mol
LogP1.78
Rot. Bonds3

About 2-(4-propylmorpholin-2-yl)-7,8-dihydro-6H-quinazolin-5-one

2-(4-propylmorpholin-2-yl)-7,8-dihydro-6H-quinazolin-5-one (PubChem CID 79658032) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is 2-(4-propylmorpholin-2-yl)-7,8-dihydro-6H-quinazolin-5-one.

Molecular Properties

Compound Name2-(4-propylmorpholin-2-yl)-7,8-dihydro-6H-quinazolin-5-one
PubChem CID79658032
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC Name2-(4-propylmorpholin-2-yl)-7,8-dihydro-6H-quinazolin-5-one
SMILESCCCN1CCOC(c2ncc3c(n2)CCCC3=O)C1
InChIInChI=1S/C15H21N3O2/c1-2-6-18-7-8-20-14(10-18)15-16-9-11-12(17-15)4-3-5-13(11)19/h9,14H,2-8,10H2,1H3
InChIKeyRPGDLPGITVSCGN-UHFFFAOYSA-N
XLogP1.78
TPSA55.32 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 51.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-Amino-5,6,7,8-tetrahydroquinazolin-5-one
CID 5200220
2-Oxo-2-[(5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)amino]ethyl morpholine-4-carbodithioate
CID 2015259
2-amino-7-methyl-7,8-dihydroquinazolin-5(6H)-one
CID 3426161
7,7-Dimethyl-2-(oxolan-2-ylmethylamino)-6,8-dihydroquinazolin-5-one
CID 665051
7-methyl-2-[(tetrahydrofuran-2-ylmethyl)amino]-7,8-dihydroquinazolin-5(6H)-one
CID 665450
7-Methyl-2-morpholin-4-yl-6,7,8-trihydroquinazolin-5-one
CID 2980039
2-Morpholin-4-yl-6,7,8-trihydroquinazolin-5-one
CID 5306361
7-Methyl-2-piperidyl-6,7,8-trihydroquinazolin-5-one
CID 2984723
2-(3,5-dimethylpiperidin-1-yl)-7-methyl-7,8-dihydroquinazolin-5(6H)-one
CID 4305340
7,8-Dihydroquinazolin-5(6H)-one
CID 21859127
2-(3,5-dimethylpiperidin-1-yl)-7,7-dimethyl-7,8-dihydroquinazolin-5(6H)-one
CID 3589722
7,8-Dihydro-7,7-dimethyl-2-(1-pyrrolidinyl)-5(6H)-quinazolinone
CID 12034393

Frequently Asked Questions

What is the IUPAC name of 2-(4-propylmorpholin-2-yl)-7,8-dihydro-6H-quinazolin-5-one?
The IUPAC name of 2-(4-propylmorpholin-2-yl)-7,8-dihydro-6H-quinazolin-5-one (CID 79658032) is 2-(4-propylmorpholin-2-yl)-7,8-dihydro-6H-quinazolin-5-one.
What is the SMILES notation for 2-(4-propylmorpholin-2-yl)-7,8-dihydro-6H-quinazolin-5-one?
The canonical SMILES for 2-(4-propylmorpholin-2-yl)-7,8-dihydro-6H-quinazolin-5-one is CCCN1CCOC(c2ncc3c(n2)CCCC3=O)C1.
What is the InChIKey of 2-(4-propylmorpholin-2-yl)-7,8-dihydro-6H-quinazolin-5-one?
The InChIKey is RPGDLPGITVSCGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2/c1-2-6-18-7-8-20-14(10-18)15-16-9-11-12(17-15)4-3-5-13(11)19/h9,14H,2-8,10H2,1H3.
What are the key properties of 2-(4-propylmorpholin-2-yl)-7,8-dihydro-6H-quinazolin-5-one?
2-(4-propylmorpholin-2-yl)-7,8-dihydro-6H-quinazolin-5-one has a molecular weight of 275.35 g/mol, XLogP of 1.78, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-propylmorpholin-2-yl)-7,8-dihydro-6H-quinazolin-5-one is sourced from PubChem (CID 79658032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).