N-[2-(diethylamino)ethyl]-2-(2-pyridin-2-ylbenzimidazol-1-yl)acetamide

C20H25N5O — CID 2959501

IUPACN-[2-(diethylamino)ethyl]-2-(2-pyridin-2-ylbenzimidazol-1-yl)acetamide
SMILESCCN(CC)CCNC(=O)Cn1c(-c2ccccn2)nc2ccccc21
InChIInChI=1S/C20H25N5O/c1-3-24(4-2)14-13-22-19(26)15-25-18-11-6-5-9-16(18)23-20(25)17-10-7-8-12-21-17/h5-12H,3-4,13-15H2,1-2H3,(H,22,26)
InChIKeyGQFDOZWMSJOQCS-UHFFFAOYSA-N
MW351.45 g/mol
LogP2.56
Rot. Bonds8

About N-[2-(diethylamino)ethyl]-2-(2-pyridin-2-ylbenzimidazol-1-yl)acetamide

N-[2-(diethylamino)ethyl]-2-(2-pyridin-2-ylbenzimidazol-1-yl)acetamide (PubChem CID 2959501) has the molecular formula C20H25N5O and a molecular weight of 351.45 g/mol. Its IUPAC name is N-[2-(diethylamino)ethyl]-2-(2-pyridin-2-ylbenzimidazol-1-yl)acetamide.

Molecular Properties

Compound NameN-[2-(diethylamino)ethyl]-2-(2-pyridin-2-ylbenzimidazol-1-yl)acetamide
PubChem CID2959501
Molecular FormulaC20H25N5O
Molecular Weight351.45 g/mol
Exact Mass351.21
IUPAC NameN-[2-(diethylamino)ethyl]-2-(2-pyridin-2-ylbenzimidazol-1-yl)acetamide
SMILESCCN(CC)CCNC(=O)Cn1c(-c2ccccn2)nc2ccccc21
InChIInChI=1S/C20H25N5O/c1-3-24(4-2)14-13-22-19(26)15-25-18-11-6-5-9-16(18)23-20(25)17-10-7-8-12-21-17/h5-12H,3-4,13-15H2,1-2H3,(H,22,26)
InChIKeyGQFDOZWMSJOQCS-UHFFFAOYSA-N
XLogP2.56
TPSA63.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.45
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2-(diethylamino)ethyl]-2-(2-pyridin-2-ylbenzimidazol-1-yl)acetamide?
The IUPAC name of N-[2-(diethylamino)ethyl]-2-(2-pyridin-2-ylbenzimidazol-1-yl)acetamide (CID 2959501) is N-[2-(diethylamino)ethyl]-2-(2-pyridin-2-ylbenzimidazol-1-yl)acetamide.
What is the SMILES notation for N-[2-(diethylamino)ethyl]-2-(2-pyridin-2-ylbenzimidazol-1-yl)acetamide?
The canonical SMILES for N-[2-(diethylamino)ethyl]-2-(2-pyridin-2-ylbenzimidazol-1-yl)acetamide is CCN(CC)CCNC(=O)Cn1c(-c2ccccn2)nc2ccccc21.
What is the InChIKey of N-[2-(diethylamino)ethyl]-2-(2-pyridin-2-ylbenzimidazol-1-yl)acetamide?
The InChIKey is GQFDOZWMSJOQCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N5O/c1-3-24(4-2)14-13-22-19(26)15-25-18-11-6-5-9-16(18)23-20(25)17-10-7-8-12-21-17/h5-12H,3-4,13-15H2,1-2H3,(H,22,26).
What are the key properties of N-[2-(diethylamino)ethyl]-2-(2-pyridin-2-ylbenzimidazol-1-yl)acetamide?
N-[2-(diethylamino)ethyl]-2-(2-pyridin-2-ylbenzimidazol-1-yl)acetamide has a molecular weight of 351.45 g/mol, XLogP of 2.56, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(diethylamino)ethyl]-2-(2-pyridin-2-ylbenzimidazol-1-yl)acetamide is sourced from PubChem (CID 2959501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).