N-methyl-4-(1-phenyl-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-7-yl)benzamide;molecular hydrogen

C24H23N3O — CID 145171921

IUPACN-methyl-4-(1-phenyl-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-7-yl)benzamide;molecular hydrogen
SMILESCNC(=O)c1ccc(-c2ccc3nc4n(c3c2)C(c2ccccc2)CC4)cc1.[H][H]
InChIInChI=1S/C24H21N3O.H2/c1-25-24(28)18-9-7-16(8-10-18)19-11-12-20-22(15-19)27-21(13-14-23(27)26-20)17-5-3-2-4-6-17;/h2-12,15,21H,13-14H2,1H3,(H,25,28);1H
InChIKeyNCWRARDVIVHHOY-UHFFFAOYSA-N
MW369.47 g/mol
LogP4.84
Rot. Bonds3

About N-methyl-4-(1-phenyl-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-7-yl)benzamide;molecular hydrogen

N-methyl-4-(1-phenyl-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-7-yl)benzamide;molecular hydrogen (PubChem CID 145171921) has the molecular formula C24H23N3O and a molecular weight of 369.47 g/mol. Its IUPAC name is N-methyl-4-(1-phenyl-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-7-yl)benzamide;molecular hydrogen.

Molecular Properties

Compound NameN-methyl-4-(1-phenyl-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-7-yl)benzamide;molecular hydrogen
PubChem CID145171921
Molecular FormulaC24H23N3O
Molecular Weight369.47 g/mol
Exact Mass369.18
IUPAC NameN-methyl-4-(1-phenyl-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-7-yl)benzamide;molecular hydrogen
SMILESCNC(=O)c1ccc(-c2ccc3nc4n(c3c2)C(c2ccccc2)CC4)cc1.[H][H]
InChIInChI=1S/C24H21N3O.H2/c1-25-24(28)18-9-7-16(8-10-18)19-11-12-20-22(15-19)27-21(13-14-23(27)26-20)17-5-3-2-4-6-17;/h2-12,15,21H,13-14H2,1H3,(H,25,28);1H
InChIKeyNCWRARDVIVHHOY-UHFFFAOYSA-N
XLogP4.84
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.47
LogP ≤ 54.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-methyl-4-(1-phenyl-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-7-yl)benzamide;molecular hydrogen with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-(1-phenyl-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-7-yl)benzamide;molecular hydrogen?
The IUPAC name of N-methyl-4-(1-phenyl-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-7-yl)benzamide;molecular hydrogen (CID 145171921) is N-methyl-4-(1-phenyl-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-7-yl)benzamide;molecular hydrogen.
What is the SMILES notation for N-methyl-4-(1-phenyl-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-7-yl)benzamide;molecular hydrogen?
The canonical SMILES for N-methyl-4-(1-phenyl-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-7-yl)benzamide;molecular hydrogen is CNC(=O)c1ccc(-c2ccc3nc4n(c3c2)C(c2ccccc2)CC4)cc1.[H][H].
What is the InChIKey of N-methyl-4-(1-phenyl-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-7-yl)benzamide;molecular hydrogen?
The InChIKey is NCWRARDVIVHHOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N3O.H2/c1-25-24(28)18-9-7-16(8-10-18)19-11-12-20-22(15-19)27-21(13-14-23(27)26-20)17-5-3-2-4-6-17;/h2-12,15,21H,13-14H2,1H3,(H,25,28);1H.
What are the key properties of N-methyl-4-(1-phenyl-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-7-yl)benzamide;molecular hydrogen?
N-methyl-4-(1-phenyl-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-7-yl)benzamide;molecular hydrogen has a molecular weight of 369.47 g/mol, XLogP of 4.84, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-(1-phenyl-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-7-yl)benzamide;molecular hydrogen is sourced from PubChem (CID 145171921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).