N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(1H-imidazol-2-yl)benzamide

C18H20N4O2 — CID 74242160

IUPACN-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(1H-imidazol-2-yl)benzamide
SMILESCN(C)C(CNC(=O)c1ccccc1-c1ncc[nH]1)c1ccco1
InChIInChI=1S/C18H20N4O2/c1-22(2)15(16-8-5-11-24-16)12-21-18(23)14-7-4-3-6-13(14)17-19-9-10-20-17/h3-11,15H,12H2,1-2H3,(H,19,20)(H,21,23)
InChIKeyKUBKFWQDFALRCJ-UHFFFAOYSA-N
MW324.38 g/mol
LogP2.70
Rot. Bonds6

About N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(1H-imidazol-2-yl)benzamide

N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(1H-imidazol-2-yl)benzamide (PubChem CID 74242160) has the molecular formula C18H20N4O2 and a molecular weight of 324.38 g/mol. Its IUPAC name is N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(1H-imidazol-2-yl)benzamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(1H-imidazol-2-yl)benzamide
PubChem CID74242160
Molecular FormulaC18H20N4O2
Molecular Weight324.38 g/mol
Exact Mass324.16
IUPAC NameN-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(1H-imidazol-2-yl)benzamide
SMILESCN(C)C(CNC(=O)c1ccccc1-c1ncc[nH]1)c1ccco1
InChIInChI=1S/C18H20N4O2/c1-22(2)15(16-8-5-11-24-16)12-21-18(23)14-7-4-3-6-13(14)17-19-9-10-20-17/h3-11,15H,12H2,1-2H3,(H,19,20)(H,21,23)
InChIKeyKUBKFWQDFALRCJ-UHFFFAOYSA-N
XLogP2.70
TPSA74.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 52.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(1H-imidazol-2-yl)benzamide?
The IUPAC name of N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(1H-imidazol-2-yl)benzamide (CID 74242160) is N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(1H-imidazol-2-yl)benzamide.
What is the SMILES notation for N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(1H-imidazol-2-yl)benzamide?
The canonical SMILES for N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(1H-imidazol-2-yl)benzamide is CN(C)C(CNC(=O)c1ccccc1-c1ncc[nH]1)c1ccco1.
What is the InChIKey of N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(1H-imidazol-2-yl)benzamide?
The InChIKey is KUBKFWQDFALRCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4O2/c1-22(2)15(16-8-5-11-24-16)12-21-18(23)14-7-4-3-6-13(14)17-19-9-10-20-17/h3-11,15H,12H2,1-2H3,(H,19,20)(H,21,23).
What are the key properties of N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(1H-imidazol-2-yl)benzamide?
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(1H-imidazol-2-yl)benzamide has a molecular weight of 324.38 g/mol, XLogP of 2.70, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(1H-imidazol-2-yl)benzamide is sourced from PubChem (CID 74242160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).