(2-methyl-3H-benzimidazol-5-yl)-[2-(2-methyl-4-pyridinyl)morpholin-4-yl]methanone

C19H20N4O2 — CID 110102686

IUPAC(2-methyl-3H-benzimidazol-5-yl)-[2-(2-methyl-4-pyridinyl)morpholin-4-yl]methanone
SMILESCc1cc(C2CN(C(=O)c3ccc4nc(C)[nH]c4c3)CCO2)ccn1
InChIInChI=1S/C19H20N4O2/c1-12-9-14(5-6-20-12)18-11-23(7-8-25-18)19(24)15-3-4-16-17(10-15)22-13(2)21-16/h3-6,9-10,18H,7-8,11H2,1-2H3,(H,21,22)
InChIKeyDOOAODFOTNEEAW-UHFFFAOYSA-N
MW336.40 g/mol
LogP2.79
Rot. Bonds2

About (2-methyl-3H-benzimidazol-5-yl)-[2-(2-methyl-4-pyridinyl)morpholin-4-yl]methanone

(2-methyl-3H-benzimidazol-5-yl)-[2-(2-methyl-4-pyridinyl)morpholin-4-yl]methanone (PubChem CID 110102686) has the molecular formula C19H20N4O2 and a molecular weight of 336.40 g/mol. Its IUPAC name is (2-methyl-3H-benzimidazol-5-yl)-[2-(2-methyl-4-pyridinyl)morpholin-4-yl]methanone.

Molecular Properties

Compound Name(2-methyl-3H-benzimidazol-5-yl)-[2-(2-methyl-4-pyridinyl)morpholin-4-yl]methanone
PubChem CID110102686
Molecular FormulaC19H20N4O2
Molecular Weight336.40 g/mol
Exact Mass336.16
IUPAC Name(2-methyl-3H-benzimidazol-5-yl)-[2-(2-methyl-4-pyridinyl)morpholin-4-yl]methanone
SMILESCc1cc(C2CN(C(=O)c3ccc4nc(C)[nH]c4c3)CCO2)ccn1
InChIInChI=1S/C19H20N4O2/c1-12-9-14(5-6-20-12)18-11-23(7-8-25-18)19(24)15-3-4-16-17(10-15)22-13(2)21-16/h3-6,9-10,18H,7-8,11H2,1-2H3,(H,21,22)
InChIKeyDOOAODFOTNEEAW-UHFFFAOYSA-N
XLogP2.79
TPSA71.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.40
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (2-methyl-3H-benzimidazol-5-yl)-[2-(2-methyl-4-pyridinyl)morpholin-4-yl]methanone with MolForge

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Related Compounds

[(2R)-2-(3-aminopyrazin-2-yl)morpholin-4-yl]-(2-methyl-3H-benzimidazol-5-yl)methanone
CID 124975236
4-methyl-2-[4-(2-methyl-3H-benzimidazole-5-carbonyl)morpholin-2-yl]-1H-pyrimidin-6-one
CID 136844301
2,3-dihydro-1H-inden-5-yl-[(2R)-2-(2-methyl-4-pyridinyl)morpholin-4-yl]methanone
CID 125019087
[(2R)-2-(2-methyl-4-pyridinyl)morpholin-4-yl]-(4-pyrrolidin-1-ylphenyl)methanone
CID 125009661
[(2R)-2-(2-methyl-4-pyridinyl)morpholin-4-yl]-(5-methylthiophen-2-yl)methanone
CID 124949665
[(2R)-2-[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]morpholin-4-yl]-(2-methyl-3H-benzimidazol-5-yl)methanone
CID 92604247
5,6-dimethyl-3-[(2R)-2-(2-methyl-4-pyridinyl)morpholine-4-carbonyl]-1H-pyridin-2-one
CID 124980669
(1-methylimidazol-2-yl)-[2-(2-methyl-4-pyridinyl)morpholin-4-yl]methanone
CID 110102627
[2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]-quinolin-6-ylmethanone
CID 110115591
1-(2-methyl-3H-benzimidazole-5-carbonyl)pyrrolidine-3-carboxylic acid
CID 110089596
(3R)-1-(2-methyl-3H-benzimidazole-5-carbonyl)pyrrolidine-3-carboxylic acid
CID 125025602
4-methyl-2-[(2S)-4-(quinoline-6-carbonyl)morpholin-2-yl]-1H-pyrimidin-6-one
CID 137037891

Frequently Asked Questions

What is the IUPAC name of (2-methyl-3H-benzimidazol-5-yl)-[2-(2-methyl-4-pyridinyl)morpholin-4-yl]methanone?
The IUPAC name of (2-methyl-3H-benzimidazol-5-yl)-[2-(2-methyl-4-pyridinyl)morpholin-4-yl]methanone (CID 110102686) is (2-methyl-3H-benzimidazol-5-yl)-[2-(2-methyl-4-pyridinyl)morpholin-4-yl]methanone.
What is the SMILES notation for (2-methyl-3H-benzimidazol-5-yl)-[2-(2-methyl-4-pyridinyl)morpholin-4-yl]methanone?
The canonical SMILES for (2-methyl-3H-benzimidazol-5-yl)-[2-(2-methyl-4-pyridinyl)morpholin-4-yl]methanone is Cc1cc(C2CN(C(=O)c3ccc4nc(C)[nH]c4c3)CCO2)ccn1.
What is the InChIKey of (2-methyl-3H-benzimidazol-5-yl)-[2-(2-methyl-4-pyridinyl)morpholin-4-yl]methanone?
The InChIKey is DOOAODFOTNEEAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O2/c1-12-9-14(5-6-20-12)18-11-23(7-8-25-18)19(24)15-3-4-16-17(10-15)22-13(2)21-16/h3-6,9-10,18H,7-8,11H2,1-2H3,(H,21,22).
What are the key properties of (2-methyl-3H-benzimidazol-5-yl)-[2-(2-methyl-4-pyridinyl)morpholin-4-yl]methanone?
(2-methyl-3H-benzimidazol-5-yl)-[2-(2-methyl-4-pyridinyl)morpholin-4-yl]methanone has a molecular weight of 336.40 g/mol, XLogP of 2.79, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methyl-3H-benzimidazol-5-yl)-[2-(2-methyl-4-pyridinyl)morpholin-4-yl]methanone is sourced from PubChem (CID 110102686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).