N-methyl-4-(1-methylimidazol-2-yl)-N-(4-morpholin-4-ylbutyl)benzamide

C20H28N4O2 — CID 119068731

IUPACN-methyl-4-(1-methylimidazol-2-yl)-N-(4-morpholin-4-ylbutyl)benzamide
SMILESCN(CCCCN1CCOCC1)C(=O)c1ccc(-c2nccn2C)cc1
InChIInChI=1S/C20H28N4O2/c1-22-12-9-21-19(22)17-5-7-18(8-6-17)20(25)23(2)10-3-4-11-24-13-15-26-16-14-24/h5-9,12H,3-4,10-11,13-16H2,1-2H3
InChIKeyAHZLGXBNIBLLKA-UHFFFAOYSA-N
MW356.47 g/mol
LogP2.27
Rot. Bonds7

About N-methyl-4-(1-methylimidazol-2-yl)-N-(4-morpholin-4-ylbutyl)benzamide

N-methyl-4-(1-methylimidazol-2-yl)-N-(4-morpholin-4-ylbutyl)benzamide (PubChem CID 119068731) has the molecular formula C20H28N4O2 and a molecular weight of 356.47 g/mol. Its IUPAC name is N-methyl-4-(1-methylimidazol-2-yl)-N-(4-morpholin-4-ylbutyl)benzamide.

Molecular Properties

Compound NameN-methyl-4-(1-methylimidazol-2-yl)-N-(4-morpholin-4-ylbutyl)benzamide
PubChem CID119068731
Molecular FormulaC20H28N4O2
Molecular Weight356.47 g/mol
Exact Mass356.22
IUPAC NameN-methyl-4-(1-methylimidazol-2-yl)-N-(4-morpholin-4-ylbutyl)benzamide
SMILESCN(CCCCN1CCOCC1)C(=O)c1ccc(-c2nccn2C)cc1
InChIInChI=1S/C20H28N4O2/c1-22-12-9-21-19(22)17-5-7-18(8-6-17)20(25)23(2)10-3-4-11-24-13-15-26-16-14-24/h5-9,12H,3-4,10-11,13-16H2,1-2H3
InChIKeyAHZLGXBNIBLLKA-UHFFFAOYSA-N
XLogP2.27
TPSA50.60 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.47
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze N-methyl-4-(1-methylimidazol-2-yl)-N-(4-morpholin-4-ylbutyl)benzamide 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-methyl-N-(3-morpholin-4-ylpropyl)benzamide
CID 67379055
N-methyl-4-(4-methylphenyl)-N-(3-pyrrolidin-1-ylpropyl)benzamide
CID 131950645
4-(1-methylimidazol-2-yl)benzoic acid
CID 23009409
(2S)-N,2-dimethyl-N-(4-morpholin-4-ylbutyl)-2,3-dihydro-1-benzofuran-5-carboxamide
CID 126443915
4-methyl-N-[[1-[(4-methylphenyl)methyl]imidazol-2-yl]methyl]-N-(2-morpholin-4-ylethyl)benzamide
CID 42819996
N-[(1-methylpyrrol-2-yl)methyl]-N-(3-morpholin-4-ylpropyl)-4-phenylbenzamide
CID 1060482
1-methyl-2-[4-(1-methylimidazol-2-yl)phenyl]imidazole
CID 1088925
3-iodo-N-methyl-N-(2-morpholin-4-ylethyl)benzamide
CID 163865741
N-methyl-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide
CID 110752355
3-bromo-N-methyl-N-(2-morpholin-4-ylethyl)benzamide
CID 110753209
formic acid;N,3,5-trimethyl-N-(2-morpholin-4-ylethyl)imidazole-4-carboxamide
CID 154909512
N,4-dimethyl-N-(2-morpholin-4-yl-2-oxoethyl)benzamide
CID 89468282

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-(1-methylimidazol-2-yl)-N-(4-morpholin-4-ylbutyl)benzamide?
The IUPAC name of N-methyl-4-(1-methylimidazol-2-yl)-N-(4-morpholin-4-ylbutyl)benzamide (CID 119068731) is N-methyl-4-(1-methylimidazol-2-yl)-N-(4-morpholin-4-ylbutyl)benzamide.
What is the SMILES notation for N-methyl-4-(1-methylimidazol-2-yl)-N-(4-morpholin-4-ylbutyl)benzamide?
The canonical SMILES for N-methyl-4-(1-methylimidazol-2-yl)-N-(4-morpholin-4-ylbutyl)benzamide is CN(CCCCN1CCOCC1)C(=O)c1ccc(-c2nccn2C)cc1.
What is the InChIKey of N-methyl-4-(1-methylimidazol-2-yl)-N-(4-morpholin-4-ylbutyl)benzamide?
The InChIKey is AHZLGXBNIBLLKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28N4O2/c1-22-12-9-21-19(22)17-5-7-18(8-6-17)20(25)23(2)10-3-4-11-24-13-15-26-16-14-24/h5-9,12H,3-4,10-11,13-16H2,1-2H3.
What are the key properties of N-methyl-4-(1-methylimidazol-2-yl)-N-(4-morpholin-4-ylbutyl)benzamide?
N-methyl-4-(1-methylimidazol-2-yl)-N-(4-morpholin-4-ylbutyl)benzamide has a molecular weight of 356.47 g/mol, XLogP of 2.27, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-(1-methylimidazol-2-yl)-N-(4-morpholin-4-ylbutyl)benzamide is sourced from PubChem (CID 119068731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).