6-methoxy-2-morpholin-4-yl-1-pyridin-3-ylbenzimidazole-5-carboxamide

C18H19N5O3 — CID 70659597

IUPAC6-methoxy-2-morpholin-4-yl-1-pyridin-3-ylbenzimidazole-5-carboxamide
SMILESCOc1cc2c(cc1C(N)=O)nc(N1CCOCC1)n2-c1cccnc1
InChIInChI=1S/C18H19N5O3/c1-25-16-10-15-14(9-13(16)17(19)24)21-18(22-5-7-26-8-6-22)23(15)12-3-2-4-20-11-12/h2-4,9-11H,5-8H2,1H3,(H2,19,24)
InChIKeyVJBJUVQHEDQQOK-UHFFFAOYSA-N
MW353.38 g/mol
LogP1.36
Rot. Bonds4

About 6-methoxy-2-morpholin-4-yl-1-pyridin-3-ylbenzimidazole-5-carboxamide

6-methoxy-2-morpholin-4-yl-1-pyridin-3-ylbenzimidazole-5-carboxamide (PubChem CID 70659597) has the molecular formula C18H19N5O3 and a molecular weight of 353.38 g/mol. Its IUPAC name is 6-methoxy-2-morpholin-4-yl-1-pyridin-3-ylbenzimidazole-5-carboxamide.

Molecular Properties

Compound Name6-methoxy-2-morpholin-4-yl-1-pyridin-3-ylbenzimidazole-5-carboxamide
PubChem CID70659597
Molecular FormulaC18H19N5O3
Molecular Weight353.38 g/mol
Exact Mass353.15
IUPAC Name6-methoxy-2-morpholin-4-yl-1-pyridin-3-ylbenzimidazole-5-carboxamide
SMILESCOc1cc2c(cc1C(N)=O)nc(N1CCOCC1)n2-c1cccnc1
InChIInChI=1S/C18H19N5O3/c1-25-16-10-15-14(9-13(16)17(19)24)21-18(22-5-7-26-8-6-22)23(15)12-3-2-4-20-11-12/h2-4,9-11H,5-8H2,1H3,(H2,19,24)
InChIKeyVJBJUVQHEDQQOK-UHFFFAOYSA-N
XLogP1.36
TPSA95.50 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.38
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

5-(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)-2-methoxybenzamide
CID 118728549
methyl 2-morpholin-4-yl-4-oxo-3-phenylquinazoline-7-carboxylate
CID 22425302
1-methyl-2-morpholin-4-yl-N-(pyridin-3-ylmethyl)benzimidazole-5-carboxamide
CID 72913541
methyl 2-[(2,5-dimethyl-1-pyridin-3-ylpyrrole-3-carbonyl)amino]-5-morpholin-4-ylbenzoate
CID 56523072
4-hydroxy-5-methyl-1-(4-morpholin-4-ylphenyl)-3-pyridin-3-ylimidazole-2-thione
CID 91052507
2-[[5-methoxy-2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]amino]benzamide
CID 117077407
7-methoxy-4-[5-(morpholine-4-carbonyl)naphthalen-2-yl]oxyquinoline-6-carboxamide
CID 169101831
(3-methoxy-4-pyridinyl)-morpholin-4-ylmethanone
CID 105063802
2-methoxy-5-[[(R)-oxan-4-yl(pyridin-3-yl)methyl]sulfamoyl]benzamide
CID 100702775
2-methoxy-5-[(4-morpholin-4-ylphenyl)sulfamoyl]benzamide
CID 39324008
N-(5-methoxy-2-morpholin-4-ylphenyl)pyridine-3-carboxamide
CID 6473397
2-methyl-1-(3-methylquinolin-4-yl)-6-morpholin-4-ylbenzimidazole-4-carboxamide
CID 134361790

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2-morpholin-4-yl-1-pyridin-3-ylbenzimidazole-5-carboxamide?
The IUPAC name of 6-methoxy-2-morpholin-4-yl-1-pyridin-3-ylbenzimidazole-5-carboxamide (CID 70659597) is 6-methoxy-2-morpholin-4-yl-1-pyridin-3-ylbenzimidazole-5-carboxamide.
What is the SMILES notation for 6-methoxy-2-morpholin-4-yl-1-pyridin-3-ylbenzimidazole-5-carboxamide?
The canonical SMILES for 6-methoxy-2-morpholin-4-yl-1-pyridin-3-ylbenzimidazole-5-carboxamide is COc1cc2c(cc1C(N)=O)nc(N1CCOCC1)n2-c1cccnc1.
What is the InChIKey of 6-methoxy-2-morpholin-4-yl-1-pyridin-3-ylbenzimidazole-5-carboxamide?
The InChIKey is VJBJUVQHEDQQOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N5O3/c1-25-16-10-15-14(9-13(16)17(19)24)21-18(22-5-7-26-8-6-22)23(15)12-3-2-4-20-11-12/h2-4,9-11H,5-8H2,1H3,(H2,19,24).
What are the key properties of 6-methoxy-2-morpholin-4-yl-1-pyridin-3-ylbenzimidazole-5-carboxamide?
6-methoxy-2-morpholin-4-yl-1-pyridin-3-ylbenzimidazole-5-carboxamide has a molecular weight of 353.38 g/mol, XLogP of 1.36, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2-morpholin-4-yl-1-pyridin-3-ylbenzimidazole-5-carboxamide is sourced from PubChem (CID 70659597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).