(2R)-N-[2-(6-methoxy-1H-benzimidazol-2-yl)ethyl]-2-methyl-3-morpholin-4-ylpropanamide

C18H26N4O3 — CID 125179788

IUPAC(2R)-N-[2-(6-methoxy-1H-benzimidazol-2-yl)ethyl]-2-methyl-3-morpholin-4-ylpropanamide
SMILESCOc1ccc2nc(CCNC(=O)[C@H](C)CN3CCOCC3)[nH]c2c1
InChIInChI=1S/C18H26N4O3/c1-13(12-22-7-9-25-10-8-22)18(23)19-6-5-17-20-15-4-3-14(24-2)11-16(15)21-17/h3-4,11,13H,5-10,12H2,1-2H3,(H,19,23)(H,20,21)/t13-/m1/s1
InChIKeyZWKOWFXIQMOOET-CYBMUJFWSA-N
MW346.43 g/mol
LogP1.20
Rot. Bonds7

About (2R)-N-[2-(6-methoxy-1H-benzimidazol-2-yl)ethyl]-2-methyl-3-morpholin-4-ylpropanamide

(2R)-N-[2-(6-methoxy-1H-benzimidazol-2-yl)ethyl]-2-methyl-3-morpholin-4-ylpropanamide (PubChem CID 125179788) has the molecular formula C18H26N4O3 and a molecular weight of 346.43 g/mol. Its IUPAC name is (2R)-N-[2-(6-methoxy-1H-benzimidazol-2-yl)ethyl]-2-methyl-3-morpholin-4-ylpropanamide.

Molecular Properties

Compound Name(2R)-N-[2-(6-methoxy-1H-benzimidazol-2-yl)ethyl]-2-methyl-3-morpholin-4-ylpropanamide
PubChem CID125179788
Molecular FormulaC18H26N4O3
Molecular Weight346.43 g/mol
Exact Mass346.20
IUPAC Name(2R)-N-[2-(6-methoxy-1H-benzimidazol-2-yl)ethyl]-2-methyl-3-morpholin-4-ylpropanamide
SMILESCOc1ccc2nc(CCNC(=O)[C@H](C)CN3CCOCC3)[nH]c2c1
InChIInChI=1S/C18H26N4O3/c1-13(12-22-7-9-25-10-8-22)18(23)19-6-5-17-20-15-4-3-14(24-2)11-16(15)21-17/h3-4,11,13H,5-10,12H2,1-2H3,(H,19,23)(H,20,21)/t13-/m1/s1
InChIKeyZWKOWFXIQMOOET-CYBMUJFWSA-N
XLogP1.20
TPSA79.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.43
LogP ≤ 51.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze (2R)-N-[2-(6-methoxy-1H-benzimidazol-2-yl)ethyl]-2-methyl-3-morpholin-4-ylpropanamide with MolForge

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Related Compounds

formic acid;N-[2-(6-methoxy-1H-benzimidazol-2-yl)ethyl]-1-morpholin-4-ylpropan-2-amine
CID 154909557
N-[2-(6-methoxy-1H-benzimidazol-2-yl)ethyl]thiomorpholine-4-carboxamide
CID 119069776
2-(6-methoxy-1H-benzimidazol-2-yl)-N-methylethanamine;hydrochloride
CID 72942363
2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[2-(6-methoxy-1H-benzimidazol-2-yl)ethyl]acetamide
CID 77089120
N-[2-(6-methoxy-1H-benzimidazol-2-yl)ethyl]-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide
CID 46937550
4-[1-(6-methoxy-1H-benzimidazol-2-yl)propyl]morpholine
CID 82336375
N-[2-(6-methoxy-1H-benzimidazol-2-yl)ethyl]-2-methylpropan-2-amine
CID 65017857
(2R)-2-methyl-N-[2-(6-methyl-1H-benzimidazol-2-yl)ethyl]-3-(1,2,4-triazol-1-yl)propanamide
CID 125178751
N-[(6-methoxy-1H-benzimidazol-2-yl)methyl]oxolane-3-carboxamide
CID 118795023
N-[2-(1H-benzimidazol-2-yl)ethyl]-4-(4-methoxyphenyl)oxane-4-carboxamide
CID 47880329
N-[2-(6-methoxy-1H-benzimidazol-2-yl)ethyl]-2-(2-methoxyethyl)-1,3-benzoxazole-6-carboxamide
CID 42528796
4-(6-methoxy-1H-benzimidazol-2-yl)butan-2-amine
CID 65018041

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[2-(6-methoxy-1H-benzimidazol-2-yl)ethyl]-2-methyl-3-morpholin-4-ylpropanamide?
The IUPAC name of (2R)-N-[2-(6-methoxy-1H-benzimidazol-2-yl)ethyl]-2-methyl-3-morpholin-4-ylpropanamide (CID 125179788) is (2R)-N-[2-(6-methoxy-1H-benzimidazol-2-yl)ethyl]-2-methyl-3-morpholin-4-ylpropanamide.
What is the SMILES notation for (2R)-N-[2-(6-methoxy-1H-benzimidazol-2-yl)ethyl]-2-methyl-3-morpholin-4-ylpropanamide?
The canonical SMILES for (2R)-N-[2-(6-methoxy-1H-benzimidazol-2-yl)ethyl]-2-methyl-3-morpholin-4-ylpropanamide is COc1ccc2nc(CCNC(=O)[C@H](C)CN3CCOCC3)[nH]c2c1.
What is the InChIKey of (2R)-N-[2-(6-methoxy-1H-benzimidazol-2-yl)ethyl]-2-methyl-3-morpholin-4-ylpropanamide?
The InChIKey is ZWKOWFXIQMOOET-CYBMUJFWSA-N. The full InChI is InChI=1S/C18H26N4O3/c1-13(12-22-7-9-25-10-8-22)18(23)19-6-5-17-20-15-4-3-14(24-2)11-16(15)21-17/h3-4,11,13H,5-10,12H2,1-2H3,(H,19,23)(H,20,21)/t13-/m1/s1.
What are the key properties of (2R)-N-[2-(6-methoxy-1H-benzimidazol-2-yl)ethyl]-2-methyl-3-morpholin-4-ylpropanamide?
(2R)-N-[2-(6-methoxy-1H-benzimidazol-2-yl)ethyl]-2-methyl-3-morpholin-4-ylpropanamide has a molecular weight of 346.43 g/mol, XLogP of 1.20, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[2-(6-methoxy-1H-benzimidazol-2-yl)ethyl]-2-methyl-3-morpholin-4-ylpropanamide is sourced from PubChem (CID 125179788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).