N-cycloheptyl-2-(2-methylbenzimidazol-1-yl)acetamide

C17H23N3O — CID 4520672

IUPACN-cycloheptyl-2-(2-methylbenzimidazol-1-yl)acetamide
SMILESCc1nc2ccccc2n1CC(=O)NC1CCCCCC1
InChIInChI=1S/C17H23N3O/c1-13-18-15-10-6-7-11-16(15)20(13)12-17(21)19-14-8-4-2-3-5-9-14/h6-7,10-11,14H,2-5,8-9,12H2,1H3,(H,19,21)
InChIKeyFVOSNBHZDIZZHR-UHFFFAOYSA-N
MW285.39 g/mol
LogP3.18
Rot. Bonds3

About N-cycloheptyl-2-(2-methylbenzimidazol-1-yl)acetamide

N-cycloheptyl-2-(2-methylbenzimidazol-1-yl)acetamide (PubChem CID 4520672) has the molecular formula C17H23N3O and a molecular weight of 285.39 g/mol. Its IUPAC name is N-cycloheptyl-2-(2-methylbenzimidazol-1-yl)acetamide.

Molecular Properties

Compound NameN-cycloheptyl-2-(2-methylbenzimidazol-1-yl)acetamide
PubChem CID4520672
Molecular FormulaC17H23N3O
Molecular Weight285.39 g/mol
Exact Mass285.18
IUPAC NameN-cycloheptyl-2-(2-methylbenzimidazol-1-yl)acetamide
SMILESCc1nc2ccccc2n1CC(=O)NC1CCCCCC1
InChIInChI=1S/C17H23N3O/c1-13-18-15-10-6-7-11-16(15)20(13)12-17(21)19-14-8-4-2-3-5-9-14/h6-7,10-11,14H,2-5,8-9,12H2,1H3,(H,19,21)
InChIKeyFVOSNBHZDIZZHR-UHFFFAOYSA-N
XLogP3.18
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-2-(2-methylbenzimidazol-1-yl)acetamide?
The IUPAC name of N-cycloheptyl-2-(2-methylbenzimidazol-1-yl)acetamide (CID 4520672) is N-cycloheptyl-2-(2-methylbenzimidazol-1-yl)acetamide.
What is the SMILES notation for N-cycloheptyl-2-(2-methylbenzimidazol-1-yl)acetamide?
The canonical SMILES for N-cycloheptyl-2-(2-methylbenzimidazol-1-yl)acetamide is Cc1nc2ccccc2n1CC(=O)NC1CCCCCC1.
What is the InChIKey of N-cycloheptyl-2-(2-methylbenzimidazol-1-yl)acetamide?
The InChIKey is FVOSNBHZDIZZHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O/c1-13-18-15-10-6-7-11-16(15)20(13)12-17(21)19-14-8-4-2-3-5-9-14/h6-7,10-11,14H,2-5,8-9,12H2,1H3,(H,19,21).
What are the key properties of N-cycloheptyl-2-(2-methylbenzimidazol-1-yl)acetamide?
N-cycloheptyl-2-(2-methylbenzimidazol-1-yl)acetamide has a molecular weight of 285.39 g/mol, XLogP of 3.18, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-2-(2-methylbenzimidazol-1-yl)acetamide is sourced from PubChem (CID 4520672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).