N-(dicyclopropylmethyl)-4-(methoxymethyl)-N-methylbenzamide

C17H23NO2 — CID 49343358

IUPACN-(dicyclopropylmethyl)-4-(methoxymethyl)-N-methylbenzamide
SMILESCOCc1ccc(C(=O)N(C)C(C2CC2)C2CC2)cc1
InChIInChI=1S/C17H23NO2/c1-18(16(13-7-8-13)14-9-10-14)17(19)15-5-3-12(4-6-15)11-20-2/h3-6,13-14,16H,7-11H2,1-2H3
InChIKeyABCFAZJLLMGJLS-UHFFFAOYSA-N
MW273.38 g/mol
LogP3.09
Rot. Bonds6

About N-(dicyclopropylmethyl)-4-(methoxymethyl)-N-methylbenzamide

N-(dicyclopropylmethyl)-4-(methoxymethyl)-N-methylbenzamide (PubChem CID 49343358) has the molecular formula C17H23NO2 and a molecular weight of 273.38 g/mol. Its IUPAC name is N-(dicyclopropylmethyl)-4-(methoxymethyl)-N-methylbenzamide.

Molecular Properties

Compound NameN-(dicyclopropylmethyl)-4-(methoxymethyl)-N-methylbenzamide
PubChem CID49343358
Molecular FormulaC17H23NO2
Molecular Weight273.38 g/mol
Exact Mass273.17
IUPAC NameN-(dicyclopropylmethyl)-4-(methoxymethyl)-N-methylbenzamide
SMILESCOCc1ccc(C(=O)N(C)C(C2CC2)C2CC2)cc1
InChIInChI=1S/C17H23NO2/c1-18(16(13-7-8-13)14-9-10-14)17(19)15-5-3-12(4-6-15)11-20-2/h3-6,13-14,16H,7-11H2,1-2H3
InChIKeyABCFAZJLLMGJLS-UHFFFAOYSA-N
XLogP3.09
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-butan-2-yl-4-(methoxymethyl)-N-methylbenzamide
CID 134006113
4-(methoxymethyl)-N-methyl-N-pyrrolidin-3-ylbenzamide
CID 119553670
N-(dicyclopropylmethyl)-N-methyl-4-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]benzamide
CID 49398291
N-[(3R)-1,1-dioxothiolan-3-yl]-4-(methoxymethyl)-N-methylbenzamide
CID 38832034
N-(dicyclopropylmethyl)-6-[(dimethylamino)methyl]-N-methylpyridine-3-carboxamide
CID 126798170
N,N-bis(2-hydroxyethyl)-4-(methoxymethyl)benzamide
CID 61235842
4-(methoxymethyl)-N-[2-(4-methoxyphenoxy)ethyl]-N-methylbenzamide
CID 78794092
4-(methoxymethyl)-N-methyl-N-naphthalen-2-ylbenzamide
CID 51175212
methyl 3-[1-[4-[dicyclopropylmethyl(methyl)carbamoyl]phenyl]-3,5-dimethylpyrazol-4-yl]propanoate
CID 49343257
N-cyclopropyl-4-(methoxymethyl)-N-[1-[4-(methoxymethyl)benzoyl]pyrrolidin-3-yl]benzamide
CID 71912388
4-(methoxymethyl)-N-[(3-methoxy-4-methylsulfanylphenyl)methyl]-N-methylbenzamide
CID 60605651
4-(3-cyanophenyl)-N-(dicyclopropylmethyl)-N-methylbenzamide
CID 119061327

Frequently Asked Questions

What is the IUPAC name of N-(dicyclopropylmethyl)-4-(methoxymethyl)-N-methylbenzamide?
The IUPAC name of N-(dicyclopropylmethyl)-4-(methoxymethyl)-N-methylbenzamide (CID 49343358) is N-(dicyclopropylmethyl)-4-(methoxymethyl)-N-methylbenzamide.
What is the SMILES notation for N-(dicyclopropylmethyl)-4-(methoxymethyl)-N-methylbenzamide?
The canonical SMILES for N-(dicyclopropylmethyl)-4-(methoxymethyl)-N-methylbenzamide is COCc1ccc(C(=O)N(C)C(C2CC2)C2CC2)cc1.
What is the InChIKey of N-(dicyclopropylmethyl)-4-(methoxymethyl)-N-methylbenzamide?
The InChIKey is ABCFAZJLLMGJLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23NO2/c1-18(16(13-7-8-13)14-9-10-14)17(19)15-5-3-12(4-6-15)11-20-2/h3-6,13-14,16H,7-11H2,1-2H3.
What are the key properties of N-(dicyclopropylmethyl)-4-(methoxymethyl)-N-methylbenzamide?
N-(dicyclopropylmethyl)-4-(methoxymethyl)-N-methylbenzamide has a molecular weight of 273.38 g/mol, XLogP of 3.09, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(dicyclopropylmethyl)-4-(methoxymethyl)-N-methylbenzamide is sourced from PubChem (CID 49343358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).