N-[(1,2-dimethylbenzimidazol-5-yl)methyl]-2-(1H-indol-3-yl)acetamide

C20H20N4O — CID 110794762

IUPACN-[(1,2-dimethylbenzimidazol-5-yl)methyl]-2-(1H-indol-3-yl)acetamide
SMILESCc1nc2cc(CNC(=O)Cc3c[nH]c4ccccc34)ccc2n1C
InChIInChI=1S/C20H20N4O/c1-13-23-18-9-14(7-8-19(18)24(13)2)11-22-20(25)10-15-12-21-17-6-4-3-5-16(15)17/h3-9,12,21H,10-11H2,1-2H3,(H,22,25)
InChIKeySVYJNZDVXAIFHZ-UHFFFAOYSA-N
MW332.41 g/mol
LogP3.22
Rot. Bonds4

About N-[(1,2-dimethylbenzimidazol-5-yl)methyl]-2-(1H-indol-3-yl)acetamide

N-[(1,2-dimethylbenzimidazol-5-yl)methyl]-2-(1H-indol-3-yl)acetamide (PubChem CID 110794762) has the molecular formula C20H20N4O and a molecular weight of 332.41 g/mol. Its IUPAC name is N-[(1,2-dimethylbenzimidazol-5-yl)methyl]-2-(1H-indol-3-yl)acetamide.

Molecular Properties

Compound NameN-[(1,2-dimethylbenzimidazol-5-yl)methyl]-2-(1H-indol-3-yl)acetamide
PubChem CID110794762
Molecular FormulaC20H20N4O
Molecular Weight332.41 g/mol
Exact Mass332.16
IUPAC NameN-[(1,2-dimethylbenzimidazol-5-yl)methyl]-2-(1H-indol-3-yl)acetamide
SMILESCc1nc2cc(CNC(=O)Cc3c[nH]c4ccccc34)ccc2n1C
InChIInChI=1S/C20H20N4O/c1-13-23-18-9-14(7-8-19(18)24(13)2)11-22-20(25)10-15-12-21-17-6-4-3-5-16(15)17/h3-9,12,21H,10-11H2,1-2H3,(H,22,25)
InChIKeySVYJNZDVXAIFHZ-UHFFFAOYSA-N
XLogP3.22
TPSA62.71 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.41
LogP ≤ 53.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1,2-dimethylbenzimidazol-5-yl)-N-[(3-methylphenyl)methyl]acetamide
CID 110773123
N-[(1,2-dimethylbenzimidazol-5-yl)methyl]-2-methylbenzamide
CID 110785957
2-(1H-indol-3-yl)-N-[(2-methyl-1,3-benzoxazol-6-yl)methyl]acetamide
CID 110794630
N-[(1,2-dimethylbenzimidazol-5-yl)methyl]-4-phenoxybutanamide
CID 110794764
methyl 2-[(1,2-dimethylbenzimidazol-5-yl)methylamino]-2-oxoacetate
CID 115142414
2-(1,2-dimethylbenzimidazol-5-yl)acetohydrazide
CID 116843404
1-[(1,2-dimethylbenzimidazol-5-yl)methyl]-3-(2,2-dimethylpropyl)urea
CID 110775493
N-(1,3-benzoxazol-2-ylmethyl)-2-(1H-indol-3-yl)acetamide
CID 110741802
N-[(1,2-dimethylbenzimidazol-5-yl)methyl]-3,5-dimethoxybenzamide
CID 110785967
N-(1,3-benzoxazol-6-ylmethyl)-2-(1H-indol-3-yl)acetamide
CID 110794606
N-[(2S)-2-hydroxypropyl]-2-(1H-indol-3-yl)acetamide
CID 39248120
N-(1H-indol-3-ylmethyl)-2-(4-methoxyphenyl)acetamide
CID 110357464

Frequently Asked Questions

What is the IUPAC name of N-[(1,2-dimethylbenzimidazol-5-yl)methyl]-2-(1H-indol-3-yl)acetamide?
The IUPAC name of N-[(1,2-dimethylbenzimidazol-5-yl)methyl]-2-(1H-indol-3-yl)acetamide (CID 110794762) is N-[(1,2-dimethylbenzimidazol-5-yl)methyl]-2-(1H-indol-3-yl)acetamide.
What is the SMILES notation for N-[(1,2-dimethylbenzimidazol-5-yl)methyl]-2-(1H-indol-3-yl)acetamide?
The canonical SMILES for N-[(1,2-dimethylbenzimidazol-5-yl)methyl]-2-(1H-indol-3-yl)acetamide is Cc1nc2cc(CNC(=O)Cc3c[nH]c4ccccc34)ccc2n1C.
What is the InChIKey of N-[(1,2-dimethylbenzimidazol-5-yl)methyl]-2-(1H-indol-3-yl)acetamide?
The InChIKey is SVYJNZDVXAIFHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N4O/c1-13-23-18-9-14(7-8-19(18)24(13)2)11-22-20(25)10-15-12-21-17-6-4-3-5-16(15)17/h3-9,12,21H,10-11H2,1-2H3,(H,22,25).
What are the key properties of N-[(1,2-dimethylbenzimidazol-5-yl)methyl]-2-(1H-indol-3-yl)acetamide?
N-[(1,2-dimethylbenzimidazol-5-yl)methyl]-2-(1H-indol-3-yl)acetamide has a molecular weight of 332.41 g/mol, XLogP of 3.22, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1,2-dimethylbenzimidazol-5-yl)methyl]-2-(1H-indol-3-yl)acetamide is sourced from PubChem (CID 110794762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).