N-[2-(dimethylamino)ethyl]-3-hydroxy-N-(naphthalen-1-ylmethyl)benzamide

C22H24N2O2 — CID 20628546

IUPACN-[2-(dimethylamino)ethyl]-3-hydroxy-N-(naphthalen-1-ylmethyl)benzamide
SMILESCN(C)CCN(Cc1cccc2ccccc12)C(=O)c1cccc(O)c1
InChIInChI=1S/C22H24N2O2/c1-23(2)13-14-24(22(26)18-9-6-11-20(25)15-18)16-19-10-5-8-17-7-3-4-12-21(17)19/h3-12,15,25H,13-14,16H2,1-2H3
InChIKeyGLWNTKMGQPEVIP-UHFFFAOYSA-N
MW348.45 g/mol
LogP3.75
Rot. Bonds6

About N-[2-(dimethylamino)ethyl]-3-hydroxy-N-(naphthalen-1-ylmethyl)benzamide

N-[2-(dimethylamino)ethyl]-3-hydroxy-N-(naphthalen-1-ylmethyl)benzamide (PubChem CID 20628546) has the molecular formula C22H24N2O2 and a molecular weight of 348.45 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-3-hydroxy-N-(naphthalen-1-ylmethyl)benzamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-3-hydroxy-N-(naphthalen-1-ylmethyl)benzamide
PubChem CID20628546
Molecular FormulaC22H24N2O2
Molecular Weight348.45 g/mol
Exact Mass348.18
IUPAC NameN-[2-(dimethylamino)ethyl]-3-hydroxy-N-(naphthalen-1-ylmethyl)benzamide
SMILESCN(C)CCN(Cc1cccc2ccccc12)C(=O)c1cccc(O)c1
InChIInChI=1S/C22H24N2O2/c1-23(2)13-14-24(22(26)18-9-6-11-20(25)15-18)16-19-10-5-8-17-7-3-4-12-21(17)19/h3-12,15,25H,13-14,16H2,1-2H3
InChIKeyGLWNTKMGQPEVIP-UHFFFAOYSA-N
XLogP3.75
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.45
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-3-hydroxy-N-(naphthalen-1-ylmethyl)benzamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-3-hydroxy-N-(naphthalen-1-ylmethyl)benzamide (CID 20628546) is N-[2-(dimethylamino)ethyl]-3-hydroxy-N-(naphthalen-1-ylmethyl)benzamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-3-hydroxy-N-(naphthalen-1-ylmethyl)benzamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-3-hydroxy-N-(naphthalen-1-ylmethyl)benzamide is CN(C)CCN(Cc1cccc2ccccc12)C(=O)c1cccc(O)c1.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-3-hydroxy-N-(naphthalen-1-ylmethyl)benzamide?
The InChIKey is GLWNTKMGQPEVIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O2/c1-23(2)13-14-24(22(26)18-9-6-11-20(25)15-18)16-19-10-5-8-17-7-3-4-12-21(17)19/h3-12,15,25H,13-14,16H2,1-2H3.
What are the key properties of N-[2-(dimethylamino)ethyl]-3-hydroxy-N-(naphthalen-1-ylmethyl)benzamide?
N-[2-(dimethylamino)ethyl]-3-hydroxy-N-(naphthalen-1-ylmethyl)benzamide has a molecular weight of 348.45 g/mol, XLogP of 3.75, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-3-hydroxy-N-(naphthalen-1-ylmethyl)benzamide is sourced from PubChem (CID 20628546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).