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

C17H18N6O2 — CID 124975236

IUPAC[(2R)-2-(3-aminopyrazin-2-yl)morpholin-4-yl]-(2-methyl-3H-benzimidazol-5-yl)methanone
SMILESCc1nc2ccc(C(=O)N3CCO[C@@H](c4nccnc4N)C3)cc2[nH]1
InChIInChI=1S/C17H18N6O2/c1-10-21-12-3-2-11(8-13(12)22-10)17(24)23-6-7-25-14(9-23)15-16(18)20-5-4-19-15/h2-5,8,14H,6-7,9H2,1H3,(H2,18,20)(H,21,22)/t14-/m1/s1
InChIKeyKWKCEBUGXHYCOD-CQSZACIVSA-N
MW338.37 g/mol
LogP1.46
Rot. Bonds2

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

[(2R)-2-(3-aminopyrazin-2-yl)morpholin-4-yl]-(2-methyl-3H-benzimidazol-5-yl)methanone (PubChem CID 124975236) has the molecular formula C17H18N6O2 and a molecular weight of 338.37 g/mol. Its IUPAC name is [(2R)-2-(3-aminopyrazin-2-yl)morpholin-4-yl]-(2-methyl-3H-benzimidazol-5-yl)methanone.

Molecular Properties

Compound Name[(2R)-2-(3-aminopyrazin-2-yl)morpholin-4-yl]-(2-methyl-3H-benzimidazol-5-yl)methanone
PubChem CID124975236
Molecular FormulaC17H18N6O2
Molecular Weight338.37 g/mol
Exact Mass338.15
IUPAC Name[(2R)-2-(3-aminopyrazin-2-yl)morpholin-4-yl]-(2-methyl-3H-benzimidazol-5-yl)methanone
SMILESCc1nc2ccc(C(=O)N3CCO[C@@H](c4nccnc4N)C3)cc2[nH]1
InChIInChI=1S/C17H18N6O2/c1-10-21-12-3-2-11(8-13(12)22-10)17(24)23-6-7-25-14(9-23)15-16(18)20-5-4-19-15/h2-5,8,14H,6-7,9H2,1H3,(H2,18,20)(H,21,22)/t14-/m1/s1
InChIKeyKWKCEBUGXHYCOD-CQSZACIVSA-N
XLogP1.46
TPSA110.02 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.37
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2-methyl-3H-benzimidazol-5-yl)-[2-(2-methyl-4-pyridinyl)morpholin-4-yl]methanone
CID 110102686
4-methyl-2-[4-(2-methyl-3H-benzimidazole-5-carbonyl)morpholin-2-yl]-1H-pyrimidin-6-one
CID 136844301
[(2R)-2-(3-aminopyrazin-2-yl)morpholin-4-yl]-pyridazin-4-ylmethanone
CID 125003929
[(2R)-2-[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]morpholin-4-yl]-(2-methyl-3H-benzimidazol-5-yl)methanone
CID 92604247
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
(6R)-1-methyl-4-(2-methyl-3H-benzimidazole-5-carbonyl)-1,4-diazepane-6-carboxamide
CID 124964373
(6S)-1-methyl-4-(2-methyl-3H-benzimidazole-5-carbonyl)-1,4-diazepane-6-carboxamide
CID 124964374
[2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]-quinolin-6-ylmethanone
CID 110115591
[2-(3-aminopyrazin-2-yl)morpholin-4-yl]-(3,5-dimethyl-1,2-oxazol-4-yl)methanone
CID 110112797
(2-methyl-3H-benzimidazol-5-yl)-[4-(pyridine-2-carbonyl)piperazin-1-yl]methanone
CID 110814093
(2-methyl-3H-benzimidazol-5-yl)-[4-(3-methylbenzoyl)piperazin-1-yl]methanone
CID 110802203

Frequently Asked Questions

What is the IUPAC name of [(2R)-2-(3-aminopyrazin-2-yl)morpholin-4-yl]-(2-methyl-3H-benzimidazol-5-yl)methanone?
The IUPAC name of [(2R)-2-(3-aminopyrazin-2-yl)morpholin-4-yl]-(2-methyl-3H-benzimidazol-5-yl)methanone (CID 124975236) is [(2R)-2-(3-aminopyrazin-2-yl)morpholin-4-yl]-(2-methyl-3H-benzimidazol-5-yl)methanone.
What is the SMILES notation for [(2R)-2-(3-aminopyrazin-2-yl)morpholin-4-yl]-(2-methyl-3H-benzimidazol-5-yl)methanone?
The canonical SMILES for [(2R)-2-(3-aminopyrazin-2-yl)morpholin-4-yl]-(2-methyl-3H-benzimidazol-5-yl)methanone is Cc1nc2ccc(C(=O)N3CCO[C@@H](c4nccnc4N)C3)cc2[nH]1.
What is the InChIKey of [(2R)-2-(3-aminopyrazin-2-yl)morpholin-4-yl]-(2-methyl-3H-benzimidazol-5-yl)methanone?
The InChIKey is KWKCEBUGXHYCOD-CQSZACIVSA-N. The full InChI is InChI=1S/C17H18N6O2/c1-10-21-12-3-2-11(8-13(12)22-10)17(24)23-6-7-25-14(9-23)15-16(18)20-5-4-19-15/h2-5,8,14H,6-7,9H2,1H3,(H2,18,20)(H,21,22)/t14-/m1/s1.
What are the key properties of [(2R)-2-(3-aminopyrazin-2-yl)morpholin-4-yl]-(2-methyl-3H-benzimidazol-5-yl)methanone?
[(2R)-2-(3-aminopyrazin-2-yl)morpholin-4-yl]-(2-methyl-3H-benzimidazol-5-yl)methanone has a molecular weight of 338.37 g/mol, XLogP of 1.46, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-2-(3-aminopyrazin-2-yl)morpholin-4-yl]-(2-methyl-3H-benzimidazol-5-yl)methanone is sourced from PubChem (CID 124975236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).