N-[1-(3-methoxyphenyl)propyl]-2-[1-(4-methylphenyl)-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl]acetamide

C27H33N3O4 — CID 66679595

IUPACN-[1-(3-methoxyphenyl)propyl]-2-[1-(4-methylphenyl)-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl]acetamide
SMILESCCC(NC(=O)CN1C(=O)N(c2ccc(C)cc2)C2(CCCCC2)C1=O)c1cccc(OC)c1
InChIInChI=1S/C27H33N3O4/c1-4-23(20-9-8-10-22(17-20)34-3)28-24(31)18-29-25(32)27(15-6-5-7-16-27)30(26(29)33)21-13-11-19(2)12-14-21/h8-14,17,23H,4-7,15-16,18H2,1-3H3,(H,28,31)
InChIKeyJGUJTUBVBBRVAF-UHFFFAOYSA-N
MW463.58 g/mol
LogP4.74
Rot. Bonds7

About N-[1-(3-methoxyphenyl)propyl]-2-[1-(4-methylphenyl)-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl]acetamide

N-[1-(3-methoxyphenyl)propyl]-2-[1-(4-methylphenyl)-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl]acetamide (PubChem CID 66679595) has the molecular formula C27H33N3O4 and a molecular weight of 463.58 g/mol. Its IUPAC name is N-[1-(3-methoxyphenyl)propyl]-2-[1-(4-methylphenyl)-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl]acetamide.

Molecular Properties

Compound NameN-[1-(3-methoxyphenyl)propyl]-2-[1-(4-methylphenyl)-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl]acetamide
PubChem CID66679595
Molecular FormulaC27H33N3O4
Molecular Weight463.58 g/mol
Exact Mass463.25
IUPAC NameN-[1-(3-methoxyphenyl)propyl]-2-[1-(4-methylphenyl)-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl]acetamide
SMILESCCC(NC(=O)CN1C(=O)N(c2ccc(C)cc2)C2(CCCCC2)C1=O)c1cccc(OC)c1
InChIInChI=1S/C27H33N3O4/c1-4-23(20-9-8-10-22(17-20)34-3)28-24(31)18-29-25(32)27(15-6-5-7-16-27)30(26(29)33)21-13-11-19(2)12-14-21/h8-14,17,23H,4-7,15-16,18H2,1-3H3,(H,28,31)
InChIKeyJGUJTUBVBBRVAF-UHFFFAOYSA-N
XLogP4.74
TPSA78.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500463.58
LogP ≤ 54.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

Analyze N-[1-(3-methoxyphenyl)propyl]-2-[1-(4-methylphenyl)-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl]acetamide 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

N-[1-(3-chlorophenyl)butyl]-2-[1-[4-(hydroxymethyl)phenyl]-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl]acetamide
CID 46897238
2-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-[(1S)-1-(4-methoxyphenyl)propyl]acetamide
CID 31286642
2-[3-(4-methoxyphenyl)-2,4,5-trioxoimidazolidin-1-yl]-N-[(1R)-1-(4-methylphenyl)propyl]acetamide
CID 7491838
N-[(3-methoxyphenyl)methyl]-2-(1-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide
CID 24608696
2-(3-methoxyphenyl)-N-[(1S)-1-(4-methylphenyl)propyl]acetamide
CID 25494188
N-[2-chloro-1-(3-methoxyphenyl)ethyl]-2-(1,3-dioxoisoindol-2-yl)acetamide
CID 175143603
N-[2,6-di(propan-2-yl)phenyl]-2-[1-[4-methyl-3-(trifluoromethyl)phenyl]-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl]acetamide
CID 25226229
N-[1-(2-methoxyphenyl)ethyl]-2-(1-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide
CID 24544895
2-[8-benzoyl-1-(4-methylphenyl)-2,4-dioxo-1,3,8-triazaspiro[4.5]decan-3-yl]-N-[2,6-di(propan-2-yl)phenyl]acetamide
CID 46892741
ethyl 3-(3-methoxyphenyl)-3-[[2-[4-(4-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetyl]amino]propanoate
CID 55878079
2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[(1R)-1-(4-methylphenyl)propyl]acetamide
CID 7181954
ethyl 1-(4-methylphenyl)-4-oxo-2-sulfanylidene-1,3-diazaspiro[4.5]decane-3-carboxylate
CID 3889161

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-methoxyphenyl)propyl]-2-[1-(4-methylphenyl)-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl]acetamide?
The IUPAC name of N-[1-(3-methoxyphenyl)propyl]-2-[1-(4-methylphenyl)-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl]acetamide (CID 66679595) is N-[1-(3-methoxyphenyl)propyl]-2-[1-(4-methylphenyl)-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl]acetamide.
What is the SMILES notation for N-[1-(3-methoxyphenyl)propyl]-2-[1-(4-methylphenyl)-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl]acetamide?
The canonical SMILES for N-[1-(3-methoxyphenyl)propyl]-2-[1-(4-methylphenyl)-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl]acetamide is CCC(NC(=O)CN1C(=O)N(c2ccc(C)cc2)C2(CCCCC2)C1=O)c1cccc(OC)c1.
What is the InChIKey of N-[1-(3-methoxyphenyl)propyl]-2-[1-(4-methylphenyl)-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl]acetamide?
The InChIKey is JGUJTUBVBBRVAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H33N3O4/c1-4-23(20-9-8-10-22(17-20)34-3)28-24(31)18-29-25(32)27(15-6-5-7-16-27)30(26(29)33)21-13-11-19(2)12-14-21/h8-14,17,23H,4-7,15-16,18H2,1-3H3,(H,28,31).
What are the key properties of N-[1-(3-methoxyphenyl)propyl]-2-[1-(4-methylphenyl)-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl]acetamide?
N-[1-(3-methoxyphenyl)propyl]-2-[1-(4-methylphenyl)-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl]acetamide has a molecular weight of 463.58 g/mol, XLogP of 4.74, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-methoxyphenyl)propyl]-2-[1-(4-methylphenyl)-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl]acetamide is sourced from PubChem (CID 66679595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).