N-(1H-benzimidazol-4-yl)-6-phenylmethoxy-1H-indole-2-carboxamide

C23H18N4O2 — CID 112523091

IUPACN-(1H-benzimidazol-4-yl)-6-phenylmethoxy-1H-indole-2-carboxamide
SMILESO=C(Nc1cccc2[nH]cnc12)c1cc2ccc(OCc3ccccc3)cc2[nH]1
InChIInChI=1S/C23H18N4O2/c28-23(27-19-8-4-7-18-22(19)25-14-24-18)21-11-16-9-10-17(12-20(16)26-21)29-13-15-5-2-1-3-6-15/h1-12,14,26H,13H2,(H,24,25)(H,27,28)
InChIKeyARJNCVRZWMBZDY-UHFFFAOYSA-N
MW382.42 g/mol
LogP4.88
Rot. Bonds5

About N-(1H-benzimidazol-4-yl)-6-phenylmethoxy-1H-indole-2-carboxamide

N-(1H-benzimidazol-4-yl)-6-phenylmethoxy-1H-indole-2-carboxamide (PubChem CID 112523091) has the molecular formula C23H18N4O2 and a molecular weight of 382.42 g/mol. Its IUPAC name is N-(1H-benzimidazol-4-yl)-6-phenylmethoxy-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-(1H-benzimidazol-4-yl)-6-phenylmethoxy-1H-indole-2-carboxamide
PubChem CID112523091
Molecular FormulaC23H18N4O2
Molecular Weight382.42 g/mol
Exact Mass382.14
IUPAC NameN-(1H-benzimidazol-4-yl)-6-phenylmethoxy-1H-indole-2-carboxamide
SMILESO=C(Nc1cccc2[nH]cnc12)c1cc2ccc(OCc3ccccc3)cc2[nH]1
InChIInChI=1S/C23H18N4O2/c28-23(27-19-8-4-7-18-22(19)25-14-24-18)21-11-16-9-10-17(12-20(16)26-21)29-13-15-5-2-1-3-6-15/h1-12,14,26H,13H2,(H,24,25)(H,27,28)
InChIKeyARJNCVRZWMBZDY-UHFFFAOYSA-N
XLogP4.88
TPSA82.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.42
LogP ≤ 54.88
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze N-(1H-benzimidazol-4-yl)-6-phenylmethoxy-1H-indole-2-carboxamide 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-(1H-imidazol-2-yl)-6-phenylmethoxy-1H-indole-2-carboxamide
CID 112524377
N-(2,5-dimethylphenyl)-6-phenylmethoxy-1H-indole-2-carboxamide
CID 112520813
N-(1,3-benzoxazol-2-yl)-6-phenylmethoxy-1H-indole-2-carboxamide
CID 112528171
N-[4-(dimethylamino)phenyl]-6-phenylmethoxy-1H-indole-2-carboxamide
CID 112520492
N-[(4-chlorophenyl)methyl]-6-phenylmethoxy-1H-indole-2-carboxamide
CID 112521847
N-[2-(3-chlorophenyl)ethyl]-6-phenylmethoxy-1H-indole-2-carboxamide
CID 112529557
N-(3-chloro-4-methoxyphenyl)-6-phenylmethoxy-1H-indole-2-carboxamide
CID 112521484
N-(N'-methylcarbamimidoyl)-6-phenylmethoxy-1H-indole-2-carboxamide;hydrochloride
CID 70214874
N-[2-(4-chlorophenyl)ethyl]-6-phenylmethoxy-1H-indole-2-carboxamide
CID 112529043
6-phenylmethoxy-N-(thiophen-2-ylmethyl)-1H-indole-2-carboxamide
CID 112522105
(6-phenylmethoxy-1H-indol-2-yl)-pyrrolidin-1-ylmethanone
CID 47839341
N-(2-ethylphenyl)-6-methoxy-1H-indole-2-carboxamide
CID 134002747

Frequently Asked Questions

What is the IUPAC name of N-(1H-benzimidazol-4-yl)-6-phenylmethoxy-1H-indole-2-carboxamide?
The IUPAC name of N-(1H-benzimidazol-4-yl)-6-phenylmethoxy-1H-indole-2-carboxamide (CID 112523091) is N-(1H-benzimidazol-4-yl)-6-phenylmethoxy-1H-indole-2-carboxamide.
What is the SMILES notation for N-(1H-benzimidazol-4-yl)-6-phenylmethoxy-1H-indole-2-carboxamide?
The canonical SMILES for N-(1H-benzimidazol-4-yl)-6-phenylmethoxy-1H-indole-2-carboxamide is O=C(Nc1cccc2[nH]cnc12)c1cc2ccc(OCc3ccccc3)cc2[nH]1.
What is the InChIKey of N-(1H-benzimidazol-4-yl)-6-phenylmethoxy-1H-indole-2-carboxamide?
The InChIKey is ARJNCVRZWMBZDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18N4O2/c28-23(27-19-8-4-7-18-22(19)25-14-24-18)21-11-16-9-10-17(12-20(16)26-21)29-13-15-5-2-1-3-6-15/h1-12,14,26H,13H2,(H,24,25)(H,27,28).
What are the key properties of N-(1H-benzimidazol-4-yl)-6-phenylmethoxy-1H-indole-2-carboxamide?
N-(1H-benzimidazol-4-yl)-6-phenylmethoxy-1H-indole-2-carboxamide has a molecular weight of 382.42 g/mol, XLogP of 4.88, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-benzimidazol-4-yl)-6-phenylmethoxy-1H-indole-2-carboxamide is sourced from PubChem (CID 112523091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).