N-cyclopropyl-2-methoxy-N-[2-(3,4,5-trimethoxyphenyl)ethyl]benzamide

C22H27NO5 — CID 113095976

IUPACN-cyclopropyl-2-methoxy-N-[2-(3,4,5-trimethoxyphenyl)ethyl]benzamide
SMILESCOc1ccccc1C(=O)N(CCc1cc(OC)c(OC)c(OC)c1)C1CC1
InChIInChI=1S/C22H27NO5/c1-25-18-8-6-5-7-17(18)22(24)23(16-9-10-16)12-11-15-13-19(26-2)21(28-4)20(14-15)27-3/h5-8,13-14,16H,9-12H2,1-4H3
InChIKeyRUJRFLCSJVGPAH-UHFFFAOYSA-N
MW385.46 g/mol
LogP3.57
Rot. Bonds9

About N-cyclopropyl-2-methoxy-N-[2-(3,4,5-trimethoxyphenyl)ethyl]benzamide

N-cyclopropyl-2-methoxy-N-[2-(3,4,5-trimethoxyphenyl)ethyl]benzamide (PubChem CID 113095976) has the molecular formula C22H27NO5 and a molecular weight of 385.46 g/mol. Its IUPAC name is N-cyclopropyl-2-methoxy-N-[2-(3,4,5-trimethoxyphenyl)ethyl]benzamide.

Molecular Properties

Compound NameN-cyclopropyl-2-methoxy-N-[2-(3,4,5-trimethoxyphenyl)ethyl]benzamide
PubChem CID113095976
Molecular FormulaC22H27NO5
Molecular Weight385.46 g/mol
Exact Mass385.19
IUPAC NameN-cyclopropyl-2-methoxy-N-[2-(3,4,5-trimethoxyphenyl)ethyl]benzamide
SMILESCOc1ccccc1C(=O)N(CCc1cc(OC)c(OC)c(OC)c1)C1CC1
InChIInChI=1S/C22H27NO5/c1-25-18-8-6-5-7-17(18)22(24)23(16-9-10-16)12-11-15-13-19(26-2)21(28-4)20(14-15)27-3/h5-8,13-14,16H,9-12H2,1-4H3
InChIKeyRUJRFLCSJVGPAH-UHFFFAOYSA-N
XLogP3.57
TPSA57.23 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.46
LogP ≤ 53.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclopropyl-2-fluoro-N-[2-(3,4,5-trimethoxyphenyl)ethyl]benzamide
CID 113095973
N-cyclopropyl-N-[2-(3,4,5-trimethoxyphenyl)ethyl]benzamide
CID 113095969
N-cyclopropyl-N-[2-(3,4,5-trimethoxyphenyl)ethyl]acetamide
CID 113095956
N-cyclopropyl-2-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide
CID 113095899
N-cyclopropyl-2,2-dimethyl-N-[2-(3,4,5-trimethoxyphenyl)ethyl]propanamide
CID 113095965
(2S)-3-[cyclopropyl-(2-methoxybenzoyl)amino]-2-methylpropanoic acid
CID 95540234
3,4,5-trimethoxy-N-[(1R,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl]-N-(2-phenylethyl)benzamide
CID 98119704
N-cyclopropyl-N-(2-hydroxyethyl)-3,4,5-trimethoxybenzamide
CID 43576979
N-cyclopropyl-2-hydroxy-N-(2-hydroxyethyl)-3-methoxybenzamide
CID 43576768
N-(azetidin-3-yl)-N-ethyl-2-methoxybenzamide
CID 66182739
2-chloro-N-[(3S)-1,1-dioxothiolan-3-yl]-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide
CID 27315980
N-cyclopropyl-2-methoxy-N-[(1-methylpyrrol-2-yl)methyl]benzamide
CID 42759797

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-methoxy-N-[2-(3,4,5-trimethoxyphenyl)ethyl]benzamide?
The IUPAC name of N-cyclopropyl-2-methoxy-N-[2-(3,4,5-trimethoxyphenyl)ethyl]benzamide (CID 113095976) is N-cyclopropyl-2-methoxy-N-[2-(3,4,5-trimethoxyphenyl)ethyl]benzamide.
What is the SMILES notation for N-cyclopropyl-2-methoxy-N-[2-(3,4,5-trimethoxyphenyl)ethyl]benzamide?
The canonical SMILES for N-cyclopropyl-2-methoxy-N-[2-(3,4,5-trimethoxyphenyl)ethyl]benzamide is COc1ccccc1C(=O)N(CCc1cc(OC)c(OC)c(OC)c1)C1CC1.
What is the InChIKey of N-cyclopropyl-2-methoxy-N-[2-(3,4,5-trimethoxyphenyl)ethyl]benzamide?
The InChIKey is RUJRFLCSJVGPAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27NO5/c1-25-18-8-6-5-7-17(18)22(24)23(16-9-10-16)12-11-15-13-19(26-2)21(28-4)20(14-15)27-3/h5-8,13-14,16H,9-12H2,1-4H3.
What are the key properties of N-cyclopropyl-2-methoxy-N-[2-(3,4,5-trimethoxyphenyl)ethyl]benzamide?
N-cyclopropyl-2-methoxy-N-[2-(3,4,5-trimethoxyphenyl)ethyl]benzamide has a molecular weight of 385.46 g/mol, XLogP of 3.57, 9 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-methoxy-N-[2-(3,4,5-trimethoxyphenyl)ethyl]benzamide is sourced from PubChem (CID 113095976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).