2-methoxy-N-[(1R)-1-(1-methylbenzimidazol-2-yl)ethyl]acetamide

C13H17N3O2 — CID 751110

IUPAC2-methoxy-N-[(1R)-1-(1-methylbenzimidazol-2-yl)ethyl]acetamide
SMILESCOCC(=O)N[C@H](C)c1nc2ccccc2n1C
InChIInChI=1S/C13H17N3O2/c1-9(14-12(17)8-18-3)13-15-10-6-4-5-7-11(10)16(13)2/h4-7,9H,8H2,1-3H3,(H,14,17)/t9-/m1/s1
InChIKeyZRSAGFPOUQVJJT-SECBINFHSA-N
MW247.30 g/mol
LogP1.40
Rot. Bonds4

About 2-methoxy-N-[(1R)-1-(1-methylbenzimidazol-2-yl)ethyl]acetamide

2-methoxy-N-[(1R)-1-(1-methylbenzimidazol-2-yl)ethyl]acetamide (PubChem CID 751110) has the molecular formula C13H17N3O2 and a molecular weight of 247.30 g/mol. Its IUPAC name is 2-methoxy-N-[(1R)-1-(1-methylbenzimidazol-2-yl)ethyl]acetamide.

Molecular Properties

Compound Name2-methoxy-N-[(1R)-1-(1-methylbenzimidazol-2-yl)ethyl]acetamide
PubChem CID751110
Molecular FormulaC13H17N3O2
Molecular Weight247.30 g/mol
Exact Mass247.13
IUPAC Name2-methoxy-N-[(1R)-1-(1-methylbenzimidazol-2-yl)ethyl]acetamide
SMILESCOCC(=O)N[C@H](C)c1nc2ccccc2n1C
InChIInChI=1S/C13H17N3O2/c1-9(14-12(17)8-18-3)13-15-10-6-4-5-7-11(10)16(13)2/h4-7,9H,8H2,1-3H3,(H,14,17)/t9-/m1/s1
InChIKeyZRSAGFPOUQVJJT-SECBINFHSA-N
XLogP1.40
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.30
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1S)-1-(1-methylbenzimidazol-2-yl)ethyl]propanamide
CID 751102
2-methoxy-N-[1-(1-propylbenzimidazol-2-yl)ethyl]acetamide
CID 5013260
2-(2-methoxyethylamino)-N-[1-(1-methylbenzimidazol-2-yl)ethyl]acetamide
CID 119890038
2-methoxy-N-[1-[1-(2-methylpropyl)benzimidazol-2-yl]ethyl]acetamide
CID 16969160
N-[(1S)-1-(1-methylbenzimidazol-2-yl)ethyl]-2-phenylacetamide
CID 751118
N-[1-(1-methylbenzimidazol-2-yl)ethyl]-2-phenylacetamide
CID 4082682
2-methoxy-N-[1-[1-(3-phenylpropyl)benzimidazol-2-yl]ethyl]acetamide
CID 16969198
2-[2-[1-[(2-methoxyacetyl)amino]ethyl]benzimidazol-1-yl]-N,N-di(propan-2-yl)acetamide
CID 16969282
methyl 1-[[(1R)-1-(1-methylbenzimidazol-2-yl)ethyl]carbamoyl]cyclopropane-1-carboxylate
CID 99636066
2-(4-ethoxyphenyl)-N-[(1R)-1-(1-methylbenzimidazol-2-yl)ethyl]acetamide
CID 95772905
2-[2-[1-[(2-methoxyacetyl)amino]ethyl]benzimidazol-1-yl]-N-propylacetamide
CID 17030013
2-methoxy-N-[1-[1-[(3-methylphenyl)methyl]benzimidazol-2-yl]ethyl]acetamide
CID 16969176

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[(1R)-1-(1-methylbenzimidazol-2-yl)ethyl]acetamide?
The IUPAC name of 2-methoxy-N-[(1R)-1-(1-methylbenzimidazol-2-yl)ethyl]acetamide (CID 751110) is 2-methoxy-N-[(1R)-1-(1-methylbenzimidazol-2-yl)ethyl]acetamide.
What is the SMILES notation for 2-methoxy-N-[(1R)-1-(1-methylbenzimidazol-2-yl)ethyl]acetamide?
The canonical SMILES for 2-methoxy-N-[(1R)-1-(1-methylbenzimidazol-2-yl)ethyl]acetamide is COCC(=O)N[C@H](C)c1nc2ccccc2n1C.
What is the InChIKey of 2-methoxy-N-[(1R)-1-(1-methylbenzimidazol-2-yl)ethyl]acetamide?
The InChIKey is ZRSAGFPOUQVJJT-SECBINFHSA-N. The full InChI is InChI=1S/C13H17N3O2/c1-9(14-12(17)8-18-3)13-15-10-6-4-5-7-11(10)16(13)2/h4-7,9H,8H2,1-3H3,(H,14,17)/t9-/m1/s1.
What are the key properties of 2-methoxy-N-[(1R)-1-(1-methylbenzimidazol-2-yl)ethyl]acetamide?
2-methoxy-N-[(1R)-1-(1-methylbenzimidazol-2-yl)ethyl]acetamide has a molecular weight of 247.30 g/mol, XLogP of 1.40, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[(1R)-1-(1-methylbenzimidazol-2-yl)ethyl]acetamide is sourced from PubChem (CID 751110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).