2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-[(1-morpholin-4-ylcycloheptyl)methyl]acetamide

C18H30N4O4 — CID 131914905

IUPAC2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-[(1-morpholin-4-ylcycloheptyl)methyl]acetamide
SMILESCN1CC(=O)N(CC(=O)NCC2(N3CCOCC3)CCCCCC2)C1=O
InChIInChI=1S/C18H30N4O4/c1-20-13-16(24)22(17(20)25)12-15(23)19-14-18(6-4-2-3-5-7-18)21-8-10-26-11-9-21/h2-14H2,1H3,(H,19,23)
InChIKeyFIMRPDLVCLWIEK-UHFFFAOYSA-N
MW366.46 g/mol
LogP0.42
Rot. Bonds5

About 2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-[(1-morpholin-4-ylcycloheptyl)methyl]acetamide

2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-[(1-morpholin-4-ylcycloheptyl)methyl]acetamide (PubChem CID 131914905) has the molecular formula C18H30N4O4 and a molecular weight of 366.46 g/mol. Its IUPAC name is 2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-[(1-morpholin-4-ylcycloheptyl)methyl]acetamide.

Molecular Properties

Compound Name2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-[(1-morpholin-4-ylcycloheptyl)methyl]acetamide
PubChem CID131914905
Molecular FormulaC18H30N4O4
Molecular Weight366.46 g/mol
Exact Mass366.23
IUPAC Name2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-[(1-morpholin-4-ylcycloheptyl)methyl]acetamide
SMILESCN1CC(=O)N(CC(=O)NCC2(N3CCOCC3)CCCCCC2)C1=O
InChIInChI=1S/C18H30N4O4/c1-20-13-16(24)22(17(20)25)12-15(23)19-14-18(6-4-2-3-5-7-18)21-8-10-26-11-9-21/h2-14H2,1H3,(H,19,23)
InChIKeyFIMRPDLVCLWIEK-UHFFFAOYSA-N
XLogP0.42
TPSA82.19 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.46
LogP ≤ 50.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-[(4S)-4-cyclopropyl-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[(1-morpholin-4-ylcyclohexyl)methyl]acetamide
CID 32753985
2-(1-methylidene-3-oxoisoindol-2-yl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]acetamide
CID 18148334
2-[4-methyl-3-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]-N-[(1-morpholin-4-ylcyclohexyl)methyl]acetamide
CID 17427029
3,3-dimethyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]butanamide
CID 78789271
N-[(1-morpholin-4-ylcyclohexyl)methyl]octanamide
CID 134015029
2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-[(1-phenylcycloheptyl)methyl]acetamide
CID 99803682
2-(3,4-dichlorophenyl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]acetamide
CID 2542286
3-(5-methyl-1,3-dioxoisoindol-2-yl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]propanamide
CID 31328500
N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetamide
CID 31328585
2-[4-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]piperazin-1-yl]-N-[(1-morpholin-4-ylcyclohexyl)methyl]acetamide
CID 16579371
N-[(1-morpholin-4-ylcyclohexyl)methyl]-3-phenylpropanamide
CID 18150652
1-cyclopentyl-3-[(1-morpholin-4-ylcyclohexyl)methyl]urea
CID 38156413

Frequently Asked Questions

What is the IUPAC name of 2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-[(1-morpholin-4-ylcycloheptyl)methyl]acetamide?
The IUPAC name of 2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-[(1-morpholin-4-ylcycloheptyl)methyl]acetamide (CID 131914905) is 2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-[(1-morpholin-4-ylcycloheptyl)methyl]acetamide.
What is the SMILES notation for 2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-[(1-morpholin-4-ylcycloheptyl)methyl]acetamide?
The canonical SMILES for 2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-[(1-morpholin-4-ylcycloheptyl)methyl]acetamide is CN1CC(=O)N(CC(=O)NCC2(N3CCOCC3)CCCCCC2)C1=O.
What is the InChIKey of 2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-[(1-morpholin-4-ylcycloheptyl)methyl]acetamide?
The InChIKey is FIMRPDLVCLWIEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N4O4/c1-20-13-16(24)22(17(20)25)12-15(23)19-14-18(6-4-2-3-5-7-18)21-8-10-26-11-9-21/h2-14H2,1H3,(H,19,23).
What are the key properties of 2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-[(1-morpholin-4-ylcycloheptyl)methyl]acetamide?
2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-[(1-morpholin-4-ylcycloheptyl)methyl]acetamide has a molecular weight of 366.46 g/mol, XLogP of 0.42, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-[(1-morpholin-4-ylcycloheptyl)methyl]acetamide is sourced from PubChem (CID 131914905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).