N-(2-methylpropyl)-3-(naphthalen-2-yloxymethyl)benzamide

C22H23NO2 — CID 903861

IUPACN-(2-methylpropyl)-3-(naphthalen-2-yloxymethyl)benzamide
SMILESCC(C)CNC(=O)c1cccc(COc2ccc3ccccc3c2)c1
InChIInChI=1S/C22H23NO2/c1-16(2)14-23-22(24)20-9-5-6-17(12-20)15-25-21-11-10-18-7-3-4-8-19(18)13-21/h3-13,16H,14-15H2,1-2H3,(H,23,24)
InChIKeyVNTTXKVVDZEYCH-UHFFFAOYSA-N
MW333.43 g/mol
LogP4.80
Rot. Bonds6

About N-(2-methylpropyl)-3-(naphthalen-2-yloxymethyl)benzamide

N-(2-methylpropyl)-3-(naphthalen-2-yloxymethyl)benzamide (PubChem CID 903861) has the molecular formula C22H23NO2 and a molecular weight of 333.43 g/mol. Its IUPAC name is N-(2-methylpropyl)-3-(naphthalen-2-yloxymethyl)benzamide.

Molecular Properties

Compound NameN-(2-methylpropyl)-3-(naphthalen-2-yloxymethyl)benzamide
PubChem CID903861
Molecular FormulaC22H23NO2
Molecular Weight333.43 g/mol
Exact Mass333.17
IUPAC NameN-(2-methylpropyl)-3-(naphthalen-2-yloxymethyl)benzamide
SMILESCC(C)CNC(=O)c1cccc(COc2ccc3ccccc3c2)c1
InChIInChI=1S/C22H23NO2/c1-16(2)14-23-22(24)20-9-5-6-17(12-20)15-25-21-11-10-18-7-3-4-8-19(18)13-21/h3-13,16H,14-15H2,1-2H3,(H,23,24)
InChIKeyVNTTXKVVDZEYCH-UHFFFAOYSA-N
XLogP4.80
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.43
LogP ≤ 54.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(2-methylpropyl)-3-(naphthalen-2-yloxymethyl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(4-methoxyphenyl)-3-(naphthalen-2-yloxymethyl)benzamide
CID 1310649
3-[(4-chlorophenyl)methoxy]-N-(2-methylpropyl)benzamide
CID 13176390
N,3-bis(2-methylpropyl)benzamide
CID 176945198
N-[2-(methylamino)propyl]-3-phenylmethoxybenzamide
CID 120833158
3-[(3-fluorophenoxy)methyl]-N-[2-(methylamino)propyl]benzamide
CID 120832621
N-[(2R)-2-(ethylamino)propyl]-3-phenylmethoxybenzamide
CID 120650597
N-(3-amino-2-methylpropyl)-3-[(3-methylphenyl)methoxy]benzamide;hydrochloride
CID 119995953
3-[(4-propan-2-ylphenoxy)methyl]benzohydrazide
CID 840752
N-(4-hydroxy-2-methylpentyl)-3-[(6-methyl-3-pyridinyl)oxymethyl]benzamide
CID 111447845
3-methyl-4-[[3-[(6-methyl-3-pyridinyl)oxymethyl]benzoyl]amino]butanoic acid
CID 120537130
N-(3-hydroxybutyl)-3-phenylmethoxybenzamide
CID 111433563
N-(4-methyl-2-morpholin-4-ylpentyl)-3-phenylmethoxybenzamide
CID 46540846

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)-3-(naphthalen-2-yloxymethyl)benzamide?
The IUPAC name of N-(2-methylpropyl)-3-(naphthalen-2-yloxymethyl)benzamide (CID 903861) is N-(2-methylpropyl)-3-(naphthalen-2-yloxymethyl)benzamide.
What is the SMILES notation for N-(2-methylpropyl)-3-(naphthalen-2-yloxymethyl)benzamide?
The canonical SMILES for N-(2-methylpropyl)-3-(naphthalen-2-yloxymethyl)benzamide is CC(C)CNC(=O)c1cccc(COc2ccc3ccccc3c2)c1.
What is the InChIKey of N-(2-methylpropyl)-3-(naphthalen-2-yloxymethyl)benzamide?
The InChIKey is VNTTXKVVDZEYCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23NO2/c1-16(2)14-23-22(24)20-9-5-6-17(12-20)15-25-21-11-10-18-7-3-4-8-19(18)13-21/h3-13,16H,14-15H2,1-2H3,(H,23,24).
What are the key properties of N-(2-methylpropyl)-3-(naphthalen-2-yloxymethyl)benzamide?
N-(2-methylpropyl)-3-(naphthalen-2-yloxymethyl)benzamide has a molecular weight of 333.43 g/mol, XLogP of 4.80, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)-3-(naphthalen-2-yloxymethyl)benzamide is sourced from PubChem (CID 903861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).