2-(cyclopropylmethoxy)-N-methyl-N-(1-methylbenzimidazol-2-yl)acetamide

C15H19N3O2 — CID 86792738

IUPAC2-(cyclopropylmethoxy)-N-methyl-N-(1-methylbenzimidazol-2-yl)acetamide
SMILESCN(C(=O)COCC1CC1)c1nc2ccccc2n1C
InChIInChI=1S/C15H19N3O2/c1-17-13-6-4-3-5-12(13)16-15(17)18(2)14(19)10-20-9-11-7-8-11/h3-6,11H,7-10H2,1-2H3
InChIKeySDPQODGRHAHRGX-UHFFFAOYSA-N
MW273.34 g/mol
LogP1.96
Rot. Bonds5

About 2-(cyclopropylmethoxy)-N-methyl-N-(1-methylbenzimidazol-2-yl)acetamide

2-(cyclopropylmethoxy)-N-methyl-N-(1-methylbenzimidazol-2-yl)acetamide (PubChem CID 86792738) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is 2-(cyclopropylmethoxy)-N-methyl-N-(1-methylbenzimidazol-2-yl)acetamide.

Molecular Properties

Compound Name2-(cyclopropylmethoxy)-N-methyl-N-(1-methylbenzimidazol-2-yl)acetamide
PubChem CID86792738
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC Name2-(cyclopropylmethoxy)-N-methyl-N-(1-methylbenzimidazol-2-yl)acetamide
SMILESCN(C(=O)COCC1CC1)c1nc2ccccc2n1C
InChIInChI=1S/C15H19N3O2/c1-17-13-6-4-3-5-12(13)16-15(17)18(2)14(19)10-20-9-11-7-8-11/h3-6,11H,7-10H2,1-2H3
InChIKeySDPQODGRHAHRGX-UHFFFAOYSA-N
XLogP1.96
TPSA47.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 51.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethoxy)-N-methyl-N-(1-methylbenzimidazol-2-yl)acetamide?
The IUPAC name of 2-(cyclopropylmethoxy)-N-methyl-N-(1-methylbenzimidazol-2-yl)acetamide (CID 86792738) is 2-(cyclopropylmethoxy)-N-methyl-N-(1-methylbenzimidazol-2-yl)acetamide.
What is the SMILES notation for 2-(cyclopropylmethoxy)-N-methyl-N-(1-methylbenzimidazol-2-yl)acetamide?
The canonical SMILES for 2-(cyclopropylmethoxy)-N-methyl-N-(1-methylbenzimidazol-2-yl)acetamide is CN(C(=O)COCC1CC1)c1nc2ccccc2n1C.
What is the InChIKey of 2-(cyclopropylmethoxy)-N-methyl-N-(1-methylbenzimidazol-2-yl)acetamide?
The InChIKey is SDPQODGRHAHRGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-17-13-6-4-3-5-12(13)16-15(17)18(2)14(19)10-20-9-11-7-8-11/h3-6,11H,7-10H2,1-2H3.
What are the key properties of 2-(cyclopropylmethoxy)-N-methyl-N-(1-methylbenzimidazol-2-yl)acetamide?
2-(cyclopropylmethoxy)-N-methyl-N-(1-methylbenzimidazol-2-yl)acetamide has a molecular weight of 273.34 g/mol, XLogP of 1.96, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethoxy)-N-methyl-N-(1-methylbenzimidazol-2-yl)acetamide is sourced from PubChem (CID 86792738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).