N-(6-methylquinolin-8-yl)-2-[2-(morpholin-4-ylmethyl)benzimidazol-1-yl]acetamide

C24H25N5O2 — CID 46980051

IUPACN-(6-methylquinolin-8-yl)-2-[2-(morpholin-4-ylmethyl)benzimidazol-1-yl]acetamide
SMILESCc1cc(NC(=O)Cn2c(CN3CCOCC3)nc3ccccc32)c2ncccc2c1
InChIInChI=1S/C24H25N5O2/c1-17-13-18-5-4-8-25-24(18)20(14-17)27-23(30)16-29-21-7-3-2-6-19(21)26-22(29)15-28-9-11-31-12-10-28/h2-8,13-14H,9-12,15-16H2,1H3,(H,27,30)
InChIKeyNNJUVQMYFRREMW-UHFFFAOYSA-N
MW415.50 g/mol
LogP3.36
Rot. Bonds5

About N-(6-methylquinolin-8-yl)-2-[2-(morpholin-4-ylmethyl)benzimidazol-1-yl]acetamide

N-(6-methylquinolin-8-yl)-2-[2-(morpholin-4-ylmethyl)benzimidazol-1-yl]acetamide (PubChem CID 46980051) has the molecular formula C24H25N5O2 and a molecular weight of 415.50 g/mol. Its IUPAC name is N-(6-methylquinolin-8-yl)-2-[2-(morpholin-4-ylmethyl)benzimidazol-1-yl]acetamide.

Molecular Properties

Compound NameN-(6-methylquinolin-8-yl)-2-[2-(morpholin-4-ylmethyl)benzimidazol-1-yl]acetamide
PubChem CID46980051
Molecular FormulaC24H25N5O2
Molecular Weight415.50 g/mol
Exact Mass415.20
IUPAC NameN-(6-methylquinolin-8-yl)-2-[2-(morpholin-4-ylmethyl)benzimidazol-1-yl]acetamide
SMILESCc1cc(NC(=O)Cn2c(CN3CCOCC3)nc3ccccc32)c2ncccc2c1
InChIInChI=1S/C24H25N5O2/c1-17-13-18-5-4-8-25-24(18)20(14-17)27-23(30)16-29-21-7-3-2-6-19(21)26-22(29)15-28-9-11-31-12-10-28/h2-8,13-14H,9-12,15-16H2,1H3,(H,27,30)
InChIKeyNNJUVQMYFRREMW-UHFFFAOYSA-N
XLogP3.36
TPSA72.28 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.50
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-[[1-[4-(2,4-dimethylphenoxy)butyl]benzimidazol-2-yl]methyl]morpholine
CID 18885145
2-[2-(methylsulfanylmethyl)benzimidazol-1-yl]-N-(2-morpholin-4-ylphenyl)acetamide
CID 51254645
2-(3-methyl-2-oxoquinolin-1-yl)-N-quinolin-8-ylacetamide
CID 110680398
2-[2-(methylsulfanylmethyl)benzimidazol-1-yl]-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]acetamide
CID 37153190
N-(6-methylquinolin-8-yl)-2-phenoxyacetamide
CID 110715572
N-(2,5-dimethylphenyl)-2-[2-(phenoxymethyl)benzimidazol-1-yl]acetamide
CID 17031795
2-(2-methylindol-1-yl)-N-[3-(morpholin-4-ylmethyl)phenyl]acetamide
CID 47776662
2-(2-methylbenzimidazol-1-yl)-N-(2-morpholin-4-ylethyl)acetamide
CID 848727
N-(6-methylquinolin-8-yl)-4-[(2R)-oxolan-2-yl]piperidine-1-carboxamide
CID 99830523
N-(2,5-dimethylphenyl)-2-[2-(naphthalen-1-yloxymethyl)benzimidazol-1-yl]acetamide
CID 17032273
2-(2-ethylbenzimidazol-1-yl)-N-(oxan-4-yl)acetamide
CID 115588669
2-(2-morpholin-4-ylanilino)-N-quinolin-8-ylacetamide
CID 109010597

Frequently Asked Questions

What is the IUPAC name of N-(6-methylquinolin-8-yl)-2-[2-(morpholin-4-ylmethyl)benzimidazol-1-yl]acetamide?
The IUPAC name of N-(6-methylquinolin-8-yl)-2-[2-(morpholin-4-ylmethyl)benzimidazol-1-yl]acetamide (CID 46980051) is N-(6-methylquinolin-8-yl)-2-[2-(morpholin-4-ylmethyl)benzimidazol-1-yl]acetamide.
What is the SMILES notation for N-(6-methylquinolin-8-yl)-2-[2-(morpholin-4-ylmethyl)benzimidazol-1-yl]acetamide?
The canonical SMILES for N-(6-methylquinolin-8-yl)-2-[2-(morpholin-4-ylmethyl)benzimidazol-1-yl]acetamide is Cc1cc(NC(=O)Cn2c(CN3CCOCC3)nc3ccccc32)c2ncccc2c1.
What is the InChIKey of N-(6-methylquinolin-8-yl)-2-[2-(morpholin-4-ylmethyl)benzimidazol-1-yl]acetamide?
The InChIKey is NNJUVQMYFRREMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N5O2/c1-17-13-18-5-4-8-25-24(18)20(14-17)27-23(30)16-29-21-7-3-2-6-19(21)26-22(29)15-28-9-11-31-12-10-28/h2-8,13-14H,9-12,15-16H2,1H3,(H,27,30).
What are the key properties of N-(6-methylquinolin-8-yl)-2-[2-(morpholin-4-ylmethyl)benzimidazol-1-yl]acetamide?
N-(6-methylquinolin-8-yl)-2-[2-(morpholin-4-ylmethyl)benzimidazol-1-yl]acetamide has a molecular weight of 415.50 g/mol, XLogP of 3.36, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methylquinolin-8-yl)-2-[2-(morpholin-4-ylmethyl)benzimidazol-1-yl]acetamide is sourced from PubChem (CID 46980051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).