2-(imidazol-1-ylmethyl)-N-[1-(2-methoxyethyl)-2-methylindol-5-yl]benzamide

C23H24N4O2 — CID 46971062

IUPAC2-(imidazol-1-ylmethyl)-N-[1-(2-methoxyethyl)-2-methylindol-5-yl]benzamide
SMILESCOCCn1c(C)cc2cc(NC(=O)c3ccccc3Cn3ccnc3)ccc21
InChIInChI=1S/C23H24N4O2/c1-17-13-19-14-20(7-8-22(19)27(17)11-12-29-2)25-23(28)21-6-4-3-5-18(21)15-26-10-9-24-16-26/h3-10,13-14,16H,11-12,15H2,1-2H3,(H,25,28)
InChIKeyRVDCUKQMFIMWOH-UHFFFAOYSA-N
MW388.47 g/mol
LogP4.09
Rot. Bonds7

About 2-(imidazol-1-ylmethyl)-N-[1-(2-methoxyethyl)-2-methylindol-5-yl]benzamide

2-(imidazol-1-ylmethyl)-N-[1-(2-methoxyethyl)-2-methylindol-5-yl]benzamide (PubChem CID 46971062) has the molecular formula C23H24N4O2 and a molecular weight of 388.47 g/mol. Its IUPAC name is 2-(imidazol-1-ylmethyl)-N-[1-(2-methoxyethyl)-2-methylindol-5-yl]benzamide.

Molecular Properties

Compound Name2-(imidazol-1-ylmethyl)-N-[1-(2-methoxyethyl)-2-methylindol-5-yl]benzamide
PubChem CID46971062
Molecular FormulaC23H24N4O2
Molecular Weight388.47 g/mol
Exact Mass388.19
IUPAC Name2-(imidazol-1-ylmethyl)-N-[1-(2-methoxyethyl)-2-methylindol-5-yl]benzamide
SMILESCOCCn1c(C)cc2cc(NC(=O)c3ccccc3Cn3ccnc3)ccc21
InChIInChI=1S/C23H24N4O2/c1-17-13-19-14-20(7-8-22(19)27(17)11-12-29-2)25-23(28)21-6-4-3-5-18(21)15-26-10-9-24-16-26/h3-10,13-14,16H,11-12,15H2,1-2H3,(H,25,28)
InChIKeyRVDCUKQMFIMWOH-UHFFFAOYSA-N
XLogP4.09
TPSA61.08 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.47
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(imidazol-1-ylmethyl)-N-(2-propan-2-yl-1,3-benzothiazol-6-yl)benzamide
CID 46968730
methyl 3-[2-(imidazol-1-ylmethyl)phenyl]-2-methyl-3-oxopropanoate
CID 134280288
methyl 2-[2-(imidazol-1-ylmethyl)phenyl]acetate
CID 70825151
N-[3-(2-imidazol-1-ylethoxy)phenyl]-2-methoxybenzamide
CID 47045466
3-[1-(2-methoxyethyl)-2-methylindol-5-yl]-1-methyl-1-[(5-methyl-1H-imidazol-2-yl)methyl]urea
CID 118767137
2-ethyl-N-[1-(2-methoxyethyl)-2-methylindol-5-yl]-2,5-dihydropyrrole-1-carboxamide
CID 118788632
methoxymethyl N-[2-(imidazol-1-ylmethyl)phenyl]carbamate
CID 57306427
[2-(imidazol-1-ylmethyl)phenyl]-phenylmethanone
CID 16747937
1-[(1R)-1-(2-ethyl-1,2,4-triazol-3-yl)ethyl]-3-[1-(2-methoxyethyl)-2-methylindol-5-yl]urea
CID 126436507
N-(1-ethyl-2-phenylindol-5-yl)-2-methoxybenzamide
CID 24760244
methyl 2-[2-[[3-(2-imidazol-1-ylethoxy)phenyl]carbamoyl]phenyl]sulfanylpropanoate
CID 167881794
N-[(2R)-4-(4-fluorophenyl)butan-2-yl]-2-(imidazol-1-ylmethyl)benzamide
CID 51591760

Frequently Asked Questions

What is the IUPAC name of 2-(imidazol-1-ylmethyl)-N-[1-(2-methoxyethyl)-2-methylindol-5-yl]benzamide?
The IUPAC name of 2-(imidazol-1-ylmethyl)-N-[1-(2-methoxyethyl)-2-methylindol-5-yl]benzamide (CID 46971062) is 2-(imidazol-1-ylmethyl)-N-[1-(2-methoxyethyl)-2-methylindol-5-yl]benzamide.
What is the SMILES notation for 2-(imidazol-1-ylmethyl)-N-[1-(2-methoxyethyl)-2-methylindol-5-yl]benzamide?
The canonical SMILES for 2-(imidazol-1-ylmethyl)-N-[1-(2-methoxyethyl)-2-methylindol-5-yl]benzamide is COCCn1c(C)cc2cc(NC(=O)c3ccccc3Cn3ccnc3)ccc21.
What is the InChIKey of 2-(imidazol-1-ylmethyl)-N-[1-(2-methoxyethyl)-2-methylindol-5-yl]benzamide?
The InChIKey is RVDCUKQMFIMWOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N4O2/c1-17-13-19-14-20(7-8-22(19)27(17)11-12-29-2)25-23(28)21-6-4-3-5-18(21)15-26-10-9-24-16-26/h3-10,13-14,16H,11-12,15H2,1-2H3,(H,25,28).
What are the key properties of 2-(imidazol-1-ylmethyl)-N-[1-(2-methoxyethyl)-2-methylindol-5-yl]benzamide?
2-(imidazol-1-ylmethyl)-N-[1-(2-methoxyethyl)-2-methylindol-5-yl]benzamide has a molecular weight of 388.47 g/mol, XLogP of 4.09, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(imidazol-1-ylmethyl)-N-[1-(2-methoxyethyl)-2-methylindol-5-yl]benzamide is sourced from PubChem (CID 46971062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).