N-benzyl-1-(2-methoxyphenyl)-N-methylcyclopropane-1-carboxamide

C19H21NO2 — CID 110436719

IUPACN-benzyl-1-(2-methoxyphenyl)-N-methylcyclopropane-1-carboxamide
SMILESCOc1ccccc1C1(C(=O)N(C)Cc2ccccc2)CC1
InChIInChI=1S/C19H21NO2/c1-20(14-15-8-4-3-5-9-15)18(21)19(12-13-19)16-10-6-7-11-17(16)22-2/h3-11H,12-14H2,1-2H3
InChIKeySLXZURLAWJPTBV-UHFFFAOYSA-N
MW295.38 g/mol
LogP3.39
Rot. Bonds5

About N-benzyl-1-(2-methoxyphenyl)-N-methylcyclopropane-1-carboxamide

N-benzyl-1-(2-methoxyphenyl)-N-methylcyclopropane-1-carboxamide (PubChem CID 110436719) has the molecular formula C19H21NO2 and a molecular weight of 295.38 g/mol. Its IUPAC name is N-benzyl-1-(2-methoxyphenyl)-N-methylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-benzyl-1-(2-methoxyphenyl)-N-methylcyclopropane-1-carboxamide
PubChem CID110436719
Molecular FormulaC19H21NO2
Molecular Weight295.38 g/mol
Exact Mass295.16
IUPAC NameN-benzyl-1-(2-methoxyphenyl)-N-methylcyclopropane-1-carboxamide
SMILESCOc1ccccc1C1(C(=O)N(C)Cc2ccccc2)CC1
InChIInChI=1S/C19H21NO2/c1-20(14-15-8-4-3-5-9-15)18(21)19(12-13-19)16-10-6-7-11-17(16)22-2/h3-11H,12-14H2,1-2H3
InChIKeySLXZURLAWJPTBV-UHFFFAOYSA-N
XLogP3.39
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.38
LogP ≤ 53.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

methyl 2-[[1-(2-methoxyphenyl)cyclopropanecarbonyl]-methylamino]acetate
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N-methyl-1-phenyl-N-[(3,4,5-trimethoxyphenyl)methyl]cyclopropane-1-carboxamide
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N-benzyl-2,6-dimethoxy-N-methylbenzamide
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N-[(3-fluoro-4-methoxyphenyl)methyl]-N-methyl-1-phenylcyclobutane-1-carboxamide
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CID 23151680
N-benzyl-1-(6-fluoro-1H-indol-3-yl)-N-methylcyclopropane-1-carboxamide
CID 113211067
N-benzyl-1-(3,4-dichlorophenyl)-N-methylcyclopropane-1-carboxamide
CID 143002886
1-N'-benzyl-1-N'-methyl-1-N-(3,4,5-trimethoxyphenyl)cyclopropane-1,1-dicarboxamide
CID 108975615
1-(4-bromophenyl)-N-[(2-methoxyphenyl)methyl]-N-methylcyclopropane-1-carboxamide
CID 55521659
1-N-benzyl-1-N',1-N'-diethyl-1-N-methylcyclopropane-1,1-dicarboxamide
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CID 39909967

Frequently Asked Questions

What is the IUPAC name of N-benzyl-1-(2-methoxyphenyl)-N-methylcyclopropane-1-carboxamide?
The IUPAC name of N-benzyl-1-(2-methoxyphenyl)-N-methylcyclopropane-1-carboxamide (CID 110436719) is N-benzyl-1-(2-methoxyphenyl)-N-methylcyclopropane-1-carboxamide.
What is the SMILES notation for N-benzyl-1-(2-methoxyphenyl)-N-methylcyclopropane-1-carboxamide?
The canonical SMILES for N-benzyl-1-(2-methoxyphenyl)-N-methylcyclopropane-1-carboxamide is COc1ccccc1C1(C(=O)N(C)Cc2ccccc2)CC1.
What is the InChIKey of N-benzyl-1-(2-methoxyphenyl)-N-methylcyclopropane-1-carboxamide?
The InChIKey is SLXZURLAWJPTBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21NO2/c1-20(14-15-8-4-3-5-9-15)18(21)19(12-13-19)16-10-6-7-11-17(16)22-2/h3-11H,12-14H2,1-2H3.
What are the key properties of N-benzyl-1-(2-methoxyphenyl)-N-methylcyclopropane-1-carboxamide?
N-benzyl-1-(2-methoxyphenyl)-N-methylcyclopropane-1-carboxamide has a molecular weight of 295.38 g/mol, XLogP of 3.39, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-1-(2-methoxyphenyl)-N-methylcyclopropane-1-carboxamide is sourced from PubChem (CID 110436719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).