N-(3-aminophenyl)-4-(3-methyl-2-oxoimidazolidin-1-yl)butanamide

C14H20N4O2 — CID 62490976

IUPACN-(3-aminophenyl)-4-(3-methyl-2-oxoimidazolidin-1-yl)butanamide
SMILESCN1CCN(CCCC(=O)Nc2cccc(N)c2)C1=O
InChIInChI=1S/C14H20N4O2/c1-17-8-9-18(14(17)20)7-3-6-13(19)16-12-5-2-4-11(15)10-12/h2,4-5,10H,3,6-9,15H2,1H3,(H,16,19)
InChIKeyOPYJBYIHEBFCTR-UHFFFAOYSA-N
MW276.34 g/mol
LogP1.35
Rot. Bonds5

About N-(3-aminophenyl)-4-(3-methyl-2-oxoimidazolidin-1-yl)butanamide

N-(3-aminophenyl)-4-(3-methyl-2-oxoimidazolidin-1-yl)butanamide (PubChem CID 62490976) has the molecular formula C14H20N4O2 and a molecular weight of 276.34 g/mol. Its IUPAC name is N-(3-aminophenyl)-4-(3-methyl-2-oxoimidazolidin-1-yl)butanamide.

Molecular Properties

Compound NameN-(3-aminophenyl)-4-(3-methyl-2-oxoimidazolidin-1-yl)butanamide
PubChem CID62490976
Molecular FormulaC14H20N4O2
Molecular Weight276.34 g/mol
Exact Mass276.16
IUPAC NameN-(3-aminophenyl)-4-(3-methyl-2-oxoimidazolidin-1-yl)butanamide
SMILESCN1CCN(CCCC(=O)Nc2cccc(N)c2)C1=O
InChIInChI=1S/C14H20N4O2/c1-17-8-9-18(14(17)20)7-3-6-13(19)16-12-5-2-4-11(15)10-12/h2,4-5,10H,3,6-9,15H2,1H3,(H,16,19)
InChIKeyOPYJBYIHEBFCTR-UHFFFAOYSA-N
XLogP1.35
TPSA78.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-(3-aminophenyl)-4-(3-methyl-2-oxoimidazolidin-1-yl)butanamide 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-(3-cyanophenyl)-3-(3-methyl-2-oxoimidazolidin-1-yl)propanamide
CID 62490825
N-(3-aminophenyl)-4-(azocan-1-yl)butanamide
CID 28799889
N-(3-aminophenyl)-4-(2-methylpyrrolidin-1-yl)butanamide
CID 54881953
4-(2-amino-2-oxoethyl)sulfanyl-N-(3-aminophenyl)butanamide
CID 114231287
N-(3-aminophenyl)-4-(6-oxopyrimidin-1-yl)butanamide
CID 63767929
N-(3-aminophenyl)-4-(3-methoxypyrrolidin-1-yl)butanamide
CID 103530969
N-(4-amino-2-methylphenyl)-3-(3-methyl-2-oxoimidazolidin-1-yl)propanamide
CID 62491301
N-(3-aminophenyl)-4-(2-methylmorpholin-4-yl)butanamide
CID 16779606
N-(3-aminophenyl)-4-(3-ethylpiperidin-1-yl)butanamide
CID 43584150
N-(3-aminophenyl)-4-[(2-methylpropan-2-yl)oxy]butanamide
CID 28995330
N-(3-aminophenyl)-3-(4-methyl-1,4-diazepan-1-yl)propanamide
CID 28744833
N-(3-aminophenyl)-3-(2-methylpiperidin-1-yl)propanamide
CID 16778633

Frequently Asked Questions

What is the IUPAC name of N-(3-aminophenyl)-4-(3-methyl-2-oxoimidazolidin-1-yl)butanamide?
The IUPAC name of N-(3-aminophenyl)-4-(3-methyl-2-oxoimidazolidin-1-yl)butanamide (CID 62490976) is N-(3-aminophenyl)-4-(3-methyl-2-oxoimidazolidin-1-yl)butanamide.
What is the SMILES notation for N-(3-aminophenyl)-4-(3-methyl-2-oxoimidazolidin-1-yl)butanamide?
The canonical SMILES for N-(3-aminophenyl)-4-(3-methyl-2-oxoimidazolidin-1-yl)butanamide is CN1CCN(CCCC(=O)Nc2cccc(N)c2)C1=O.
What is the InChIKey of N-(3-aminophenyl)-4-(3-methyl-2-oxoimidazolidin-1-yl)butanamide?
The InChIKey is OPYJBYIHEBFCTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O2/c1-17-8-9-18(14(17)20)7-3-6-13(19)16-12-5-2-4-11(15)10-12/h2,4-5,10H,3,6-9,15H2,1H3,(H,16,19).
What are the key properties of N-(3-aminophenyl)-4-(3-methyl-2-oxoimidazolidin-1-yl)butanamide?
N-(3-aminophenyl)-4-(3-methyl-2-oxoimidazolidin-1-yl)butanamide has a molecular weight of 276.34 g/mol, XLogP of 1.35, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminophenyl)-4-(3-methyl-2-oxoimidazolidin-1-yl)butanamide is sourced from PubChem (CID 62490976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).