3-methyl-1-[2-oxo-2-[(5S)-6-oxo-2,7-diazaspiro[4.5]decan-2-yl]ethyl]-4H-quinazolin-2-one

C19H24N4O3 — CID 97115698

IUPAC3-methyl-1-[2-oxo-2-[(5S)-6-oxo-2,7-diazaspiro[4.5]decan-2-yl]ethyl]-4H-quinazolin-2-one
SMILESCN1Cc2ccccc2N(CC(=O)N2CC[C@@]3(CCCNC3=O)C2)C1=O
InChIInChI=1S/C19H24N4O3/c1-21-11-14-5-2-3-6-15(14)23(18(21)26)12-16(24)22-10-8-19(13-22)7-4-9-20-17(19)25/h2-3,5-6H,4,7-13H2,1H3,(H,20,25)/t19-/m0/s1
InChIKeyIXEARFQITXMWLA-IBGZPJMESA-N
MW356.43 g/mol
LogP1.19
Rot. Bonds2

About 3-methyl-1-[2-oxo-2-[(5S)-6-oxo-2,7-diazaspiro[4.5]decan-2-yl]ethyl]-4H-quinazolin-2-one

3-methyl-1-[2-oxo-2-[(5S)-6-oxo-2,7-diazaspiro[4.5]decan-2-yl]ethyl]-4H-quinazolin-2-one (PubChem CID 97115698) has the molecular formula C19H24N4O3 and a molecular weight of 356.43 g/mol. Its IUPAC name is 3-methyl-1-[2-oxo-2-[(5S)-6-oxo-2,7-diazaspiro[4.5]decan-2-yl]ethyl]-4H-quinazolin-2-one.

Molecular Properties

Compound Name3-methyl-1-[2-oxo-2-[(5S)-6-oxo-2,7-diazaspiro[4.5]decan-2-yl]ethyl]-4H-quinazolin-2-one
PubChem CID97115698
Molecular FormulaC19H24N4O3
Molecular Weight356.43 g/mol
Exact Mass356.18
IUPAC Name3-methyl-1-[2-oxo-2-[(5S)-6-oxo-2,7-diazaspiro[4.5]decan-2-yl]ethyl]-4H-quinazolin-2-one
SMILESCN1Cc2ccccc2N(CC(=O)N2CC[C@@]3(CCCNC3=O)C2)C1=O
InChIInChI=1S/C19H24N4O3/c1-21-11-14-5-2-3-6-15(14)23(18(21)26)12-16(24)22-10-8-19(13-22)7-4-9-20-17(19)25/h2-3,5-6H,4,7-13H2,1H3,(H,20,25)/t19-/m0/s1
InChIKeyIXEARFQITXMWLA-IBGZPJMESA-N
XLogP1.19
TPSA72.96 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.43
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-methyl-1-[2-oxo-2-[(5S)-6-oxo-2,7-diazaspiro[4.5]decan-2-yl]ethyl]-4H-quinazolin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-methyl-4-[2-oxo-2-[(5R)-6-oxo-2,7-diazaspiro[4.5]decan-2-yl]ethyl]-1,4-benzoxazin-3-one
CID 97145463
2-(4-methylpiperazine-1-carbonyl)-2,7-diazaspiro[4.5]decan-6-one
CID 72937627
2-(3,3,3-trifluoropropanoyl)-2,7-diazaspiro[4.5]decan-6-one
CID 72922471
(3S,4S)-4-cyclopropyl-1-[2-(3-methyl-2-oxo-4H-quinazolin-1-yl)acetyl]pyrrolidine-3-carboxylic acid
CID 72857568
9-(2-methylsulfanylacetyl)-2,9-diazaspiro[5.5]undecan-1-one
CID 98896688
2-[1-(4-methylphenyl)cyclopropanecarbonyl]-2,7-diazaspiro[4.5]decan-6-one
CID 72879316
1-(4-ethoxy-3-methylphenyl)-4-(6-oxo-2,7-diazaspiro[4.5]decan-2-yl)butane-1,4-dione
CID 72867011
1-(4-ethoxy-3-methylphenyl)-4-[(5R)-6-oxo-2,7-diazaspiro[4.5]decan-2-yl]butane-1,4-dione
CID 97122224
(5S)-N-tert-butyl-6-oxo-2,7-diazaspiro[4.5]decane-2-carboxamide
CID 97125831
1-phosphanylspiro[3,5-dihydro-2H-1-benzazepine-4,3'-piperidine]-2'-one
CID 59550564
2-(5-methyl-2-phenyl-1H-imidazole-4-carbonyl)-2,7-diazaspiro[4.5]decan-6-one
CID 72926019
(5R)-2-[2-(1-adamantylsulfanyl)acetyl]-2,7-diazaspiro[4.5]decan-6-one
CID 97150140

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-[2-oxo-2-[(5S)-6-oxo-2,7-diazaspiro[4.5]decan-2-yl]ethyl]-4H-quinazolin-2-one?
The IUPAC name of 3-methyl-1-[2-oxo-2-[(5S)-6-oxo-2,7-diazaspiro[4.5]decan-2-yl]ethyl]-4H-quinazolin-2-one (CID 97115698) is 3-methyl-1-[2-oxo-2-[(5S)-6-oxo-2,7-diazaspiro[4.5]decan-2-yl]ethyl]-4H-quinazolin-2-one.
What is the SMILES notation for 3-methyl-1-[2-oxo-2-[(5S)-6-oxo-2,7-diazaspiro[4.5]decan-2-yl]ethyl]-4H-quinazolin-2-one?
The canonical SMILES for 3-methyl-1-[2-oxo-2-[(5S)-6-oxo-2,7-diazaspiro[4.5]decan-2-yl]ethyl]-4H-quinazolin-2-one is CN1Cc2ccccc2N(CC(=O)N2CC[C@@]3(CCCNC3=O)C2)C1=O.
What is the InChIKey of 3-methyl-1-[2-oxo-2-[(5S)-6-oxo-2,7-diazaspiro[4.5]decan-2-yl]ethyl]-4H-quinazolin-2-one?
The InChIKey is IXEARFQITXMWLA-IBGZPJMESA-N. The full InChI is InChI=1S/C19H24N4O3/c1-21-11-14-5-2-3-6-15(14)23(18(21)26)12-16(24)22-10-8-19(13-22)7-4-9-20-17(19)25/h2-3,5-6H,4,7-13H2,1H3,(H,20,25)/t19-/m0/s1.
What are the key properties of 3-methyl-1-[2-oxo-2-[(5S)-6-oxo-2,7-diazaspiro[4.5]decan-2-yl]ethyl]-4H-quinazolin-2-one?
3-methyl-1-[2-oxo-2-[(5S)-6-oxo-2,7-diazaspiro[4.5]decan-2-yl]ethyl]-4H-quinazolin-2-one has a molecular weight of 356.43 g/mol, XLogP of 1.19, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-[2-oxo-2-[(5S)-6-oxo-2,7-diazaspiro[4.5]decan-2-yl]ethyl]-4H-quinazolin-2-one is sourced from PubChem (CID 97115698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).