2-methyl-6-morpholin-4-yl-1-naphthalen-2-ylbenzimidazole-4-carboxamide

C23H22N4O2 — CID 134364273

IUPAC2-methyl-6-morpholin-4-yl-1-naphthalen-2-ylbenzimidazole-4-carboxamide
SMILESCc1nc2c(C(N)=O)cc(N3CCOCC3)cc2n1-c1ccc2ccccc2c1
InChIInChI=1S/C23H22N4O2/c1-15-25-22-20(23(24)28)13-19(26-8-10-29-11-9-26)14-21(22)27(15)18-7-6-16-4-2-3-5-17(16)12-18/h2-7,12-14H,8-11H2,1H3,(H2,24,28)
InChIKeyZEXORXJBQGSNKS-UHFFFAOYSA-N
MW386.46 g/mol
LogP3.42
Rot. Bonds3

About 2-methyl-6-morpholin-4-yl-1-naphthalen-2-ylbenzimidazole-4-carboxamide

2-methyl-6-morpholin-4-yl-1-naphthalen-2-ylbenzimidazole-4-carboxamide (PubChem CID 134364273) has the molecular formula C23H22N4O2 and a molecular weight of 386.46 g/mol. Its IUPAC name is 2-methyl-6-morpholin-4-yl-1-naphthalen-2-ylbenzimidazole-4-carboxamide.

Molecular Properties

Compound Name2-methyl-6-morpholin-4-yl-1-naphthalen-2-ylbenzimidazole-4-carboxamide
PubChem CID134364273
Molecular FormulaC23H22N4O2
Molecular Weight386.46 g/mol
Exact Mass386.17
IUPAC Name2-methyl-6-morpholin-4-yl-1-naphthalen-2-ylbenzimidazole-4-carboxamide
SMILESCc1nc2c(C(N)=O)cc(N3CCOCC3)cc2n1-c1ccc2ccccc2c1
InChIInChI=1S/C23H22N4O2/c1-15-25-22-20(23(24)28)13-19(26-8-10-29-11-9-26)14-21(22)27(15)18-7-6-16-4-2-3-5-17(16)12-18/h2-7,12-14H,8-11H2,1H3,(H2,24,28)
InChIKeyZEXORXJBQGSNKS-UHFFFAOYSA-N
XLogP3.42
TPSA73.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.46
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-isoquinolin-3-yl-2-methyl-6-morpholin-4-ylbenzimidazole-4-carboxamide
CID 134364221
1-(7-chloroquinolin-3-yl)-2-methyl-6-morpholin-4-ylbenzimidazole-4-carboxamide
CID 134364268
2-methyl-1-(3-methylquinolin-4-yl)-6-morpholin-4-ylbenzimidazole-4-carboxamide
CID 134361790
1-(8-fluoro-2,3-dimethylquinolin-4-yl)-2-methyl-6-morpholin-4-ylbenzimidazole-4-carboxamide
CID 134362081
2-methyl-6-morpholin-4-yl-1-[2-(1,3-thiazol-4-yl)quinolin-4-yl]benzimidazole-4-carboxamide
CID 134361886
1-(8-cyanoquinolin-4-yl)-2-methyl-6-morpholin-4-ylbenzimidazole-4-carboxamide
CID 134361822
methyl 1-(8-chloroquinolin-3-yl)-2-methyl-6-morpholin-4-ylbenzimidazole-4-carboxylate
CID 134364259
N'-methanimidoyl-2-methyl-6-morpholin-4-yl-1-quinolin-3-ylbenzimidazole-4-carboximidamide
CID 142311459
1-(3,8-dichloroquinolin-4-yl)-2-ethyl-6-morpholin-4-ylbenzimidazole-4-carboxamide
CID 134361785
2-methyl-1-(8-methylquinolin-4-yl)-6-morpholin-4-ylbenzimidazole-4-carboxylic acid
CID 134361760
1-(8-cyanoquinolin-4-yl)-2-methyl-6-morpholin-4-ylbenzimidazole-4-carboxylic acid
CID 134362033
6-morpholin-4-yl-1H-benzimidazole-4-carboxamide
CID 123491353

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-morpholin-4-yl-1-naphthalen-2-ylbenzimidazole-4-carboxamide?
The IUPAC name of 2-methyl-6-morpholin-4-yl-1-naphthalen-2-ylbenzimidazole-4-carboxamide (CID 134364273) is 2-methyl-6-morpholin-4-yl-1-naphthalen-2-ylbenzimidazole-4-carboxamide.
What is the SMILES notation for 2-methyl-6-morpholin-4-yl-1-naphthalen-2-ylbenzimidazole-4-carboxamide?
The canonical SMILES for 2-methyl-6-morpholin-4-yl-1-naphthalen-2-ylbenzimidazole-4-carboxamide is Cc1nc2c(C(N)=O)cc(N3CCOCC3)cc2n1-c1ccc2ccccc2c1.
What is the InChIKey of 2-methyl-6-morpholin-4-yl-1-naphthalen-2-ylbenzimidazole-4-carboxamide?
The InChIKey is ZEXORXJBQGSNKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N4O2/c1-15-25-22-20(23(24)28)13-19(26-8-10-29-11-9-26)14-21(22)27(15)18-7-6-16-4-2-3-5-17(16)12-18/h2-7,12-14H,8-11H2,1H3,(H2,24,28).
What are the key properties of 2-methyl-6-morpholin-4-yl-1-naphthalen-2-ylbenzimidazole-4-carboxamide?
2-methyl-6-morpholin-4-yl-1-naphthalen-2-ylbenzimidazole-4-carboxamide has a molecular weight of 386.46 g/mol, XLogP of 3.42, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-morpholin-4-yl-1-naphthalen-2-ylbenzimidazole-4-carboxamide is sourced from PubChem (CID 134364273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).