N-[4-[2-(dimethylamino)ethoxy]phenyl]-3-(methoxymethyl)benzamide

C19H24N2O3 — CID 87006893

IUPACN-[4-[2-(dimethylamino)ethoxy]phenyl]-3-(methoxymethyl)benzamide
SMILESCOCc1cccc(C(=O)Nc2ccc(OCCN(C)C)cc2)c1
InChIInChI=1S/C19H24N2O3/c1-21(2)11-12-24-18-9-7-17(8-10-18)20-19(22)16-6-4-5-15(13-16)14-23-3/h4-10,13H,11-12,14H2,1-3H3,(H,20,22)
InChIKeyNMNFYFMFXYNHIQ-UHFFFAOYSA-N
MW328.41 g/mol
LogP3.03
Rot. Bonds8

About N-[4-[2-(dimethylamino)ethoxy]phenyl]-3-(methoxymethyl)benzamide

N-[4-[2-(dimethylamino)ethoxy]phenyl]-3-(methoxymethyl)benzamide (PubChem CID 87006893) has the molecular formula C19H24N2O3 and a molecular weight of 328.41 g/mol. Its IUPAC name is N-[4-[2-(dimethylamino)ethoxy]phenyl]-3-(methoxymethyl)benzamide.

Molecular Properties

Compound NameN-[4-[2-(dimethylamino)ethoxy]phenyl]-3-(methoxymethyl)benzamide
PubChem CID87006893
Molecular FormulaC19H24N2O3
Molecular Weight328.41 g/mol
Exact Mass328.18
IUPAC NameN-[4-[2-(dimethylamino)ethoxy]phenyl]-3-(methoxymethyl)benzamide
SMILESCOCc1cccc(C(=O)Nc2ccc(OCCN(C)C)cc2)c1
InChIInChI=1S/C19H24N2O3/c1-21(2)11-12-24-18-9-7-17(8-10-18)20-19(22)16-6-4-5-15(13-16)14-23-3/h4-10,13H,11-12,14H2,1-3H3,(H,20,22)
InChIKeyNMNFYFMFXYNHIQ-UHFFFAOYSA-N
XLogP3.03
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.41
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(dimethylamino)-N-[4-(2-methoxyethoxy)phenyl]benzamide
CID 46437083
5-bromo-N-[4-[2-(dimethylamino)ethoxy]phenyl]thiophene-3-carboxamide
CID 60793170
N-[4-(2-methoxyethoxy)phenyl]-4-(methoxymethyl)benzamide
CID 46441939
ethyl 4-[[3-(methoxymethyl)benzoyl]amino]benzoate
CID 51200273
4-benzamido-N-[3-(methoxymethyl)phenyl]benzamide
CID 32639408
3-(methoxymethyl)-N-[3-(methylcarbamoyl)phenyl]benzamide
CID 17471157
N-[4-[2-(dimethylamino)ethoxy]phenyl]-1,1,3,3-tetramethyl-2H-indene-5-carboxamide
CID 19760314
N-(4-methoxyphenyl)-3-(naphthalen-2-yloxymethyl)benzamide
CID 1310649
N-(3-iodophenyl)-3-(methoxymethyl)benzamide
CID 7603133
N-(3-fluorophenyl)-3-(methoxymethyl)benzamide
CID 17462584
4-(2-methoxyethoxy)-N-[4-(2-methoxyethoxy)phenyl]benzamide
CID 15943272
N-[3-(diethylsulfamoyl)phenyl]-3-(methoxymethyl)benzamide
CID 8777307

Frequently Asked Questions

What is the IUPAC name of N-[4-[2-(dimethylamino)ethoxy]phenyl]-3-(methoxymethyl)benzamide?
The IUPAC name of N-[4-[2-(dimethylamino)ethoxy]phenyl]-3-(methoxymethyl)benzamide (CID 87006893) is N-[4-[2-(dimethylamino)ethoxy]phenyl]-3-(methoxymethyl)benzamide.
What is the SMILES notation for N-[4-[2-(dimethylamino)ethoxy]phenyl]-3-(methoxymethyl)benzamide?
The canonical SMILES for N-[4-[2-(dimethylamino)ethoxy]phenyl]-3-(methoxymethyl)benzamide is COCc1cccc(C(=O)Nc2ccc(OCCN(C)C)cc2)c1.
What is the InChIKey of N-[4-[2-(dimethylamino)ethoxy]phenyl]-3-(methoxymethyl)benzamide?
The InChIKey is NMNFYFMFXYNHIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3/c1-21(2)11-12-24-18-9-7-17(8-10-18)20-19(22)16-6-4-5-15(13-16)14-23-3/h4-10,13H,11-12,14H2,1-3H3,(H,20,22).
What are the key properties of N-[4-[2-(dimethylamino)ethoxy]phenyl]-3-(methoxymethyl)benzamide?
N-[4-[2-(dimethylamino)ethoxy]phenyl]-3-(methoxymethyl)benzamide has a molecular weight of 328.41 g/mol, XLogP of 3.03, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[2-(dimethylamino)ethoxy]phenyl]-3-(methoxymethyl)benzamide is sourced from PubChem (CID 87006893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).