N-(3-chloro-4-methylphenyl)-3-[2-[2-methoxyethyl(methyl)amino]ethyl]benzamide

C20H25ClN2O2 — CID 146477217

IUPACN-(3-chloro-4-methylphenyl)-3-[2-[2-methoxyethyl(methyl)amino]ethyl]benzamide
SMILESCOCCN(C)CCc1cccc(C(=O)Nc2ccc(C)c(Cl)c2)c1
InChIInChI=1S/C20H25ClN2O2/c1-15-7-8-18(14-19(15)21)22-20(24)17-6-4-5-16(13-17)9-10-23(2)11-12-25-3/h4-8,13-14H,9-12H2,1-3H3,(H,22,24)
InChIKeyUPGKJPOYDYNTRM-UHFFFAOYSA-N
MW360.89 g/mol
LogP4.02
Rot. Bonds8

About N-(3-chloro-4-methylphenyl)-3-[2-[2-methoxyethyl(methyl)amino]ethyl]benzamide

N-(3-chloro-4-methylphenyl)-3-[2-[2-methoxyethyl(methyl)amino]ethyl]benzamide (PubChem CID 146477217) has the molecular formula C20H25ClN2O2 and a molecular weight of 360.89 g/mol. Its IUPAC name is N-(3-chloro-4-methylphenyl)-3-[2-[2-methoxyethyl(methyl)amino]ethyl]benzamide.

Molecular Properties

Compound NameN-(3-chloro-4-methylphenyl)-3-[2-[2-methoxyethyl(methyl)amino]ethyl]benzamide
PubChem CID146477217
Molecular FormulaC20H25ClN2O2
Molecular Weight360.89 g/mol
Exact Mass360.16
IUPAC NameN-(3-chloro-4-methylphenyl)-3-[2-[2-methoxyethyl(methyl)amino]ethyl]benzamide
SMILESCOCCN(C)CCc1cccc(C(=O)Nc2ccc(C)c(Cl)c2)c1
InChIInChI=1S/C20H25ClN2O2/c1-15-7-8-18(14-19(15)21)22-20(24)17-6-4-5-16(13-17)9-10-23(2)11-12-25-3/h4-8,13-14H,9-12H2,1-3H3,(H,22,24)
InChIKeyUPGKJPOYDYNTRM-UHFFFAOYSA-N
XLogP4.02
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.89
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 17134668
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CID 109020626
3,5-dichloro-N-(3-chloro-4-methylphenyl)-4-methoxybenzamide
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3-N-(3-chloro-4-methoxyphenyl)-1-N-[2-(dimethylamino)ethyl]benzene-1,3-dicarboxamide
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Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-4-methylphenyl)-3-[2-[2-methoxyethyl(methyl)amino]ethyl]benzamide?
The IUPAC name of N-(3-chloro-4-methylphenyl)-3-[2-[2-methoxyethyl(methyl)amino]ethyl]benzamide (CID 146477217) is N-(3-chloro-4-methylphenyl)-3-[2-[2-methoxyethyl(methyl)amino]ethyl]benzamide.
What is the SMILES notation for N-(3-chloro-4-methylphenyl)-3-[2-[2-methoxyethyl(methyl)amino]ethyl]benzamide?
The canonical SMILES for N-(3-chloro-4-methylphenyl)-3-[2-[2-methoxyethyl(methyl)amino]ethyl]benzamide is COCCN(C)CCc1cccc(C(=O)Nc2ccc(C)c(Cl)c2)c1.
What is the InChIKey of N-(3-chloro-4-methylphenyl)-3-[2-[2-methoxyethyl(methyl)amino]ethyl]benzamide?
The InChIKey is UPGKJPOYDYNTRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25ClN2O2/c1-15-7-8-18(14-19(15)21)22-20(24)17-6-4-5-16(13-17)9-10-23(2)11-12-25-3/h4-8,13-14H,9-12H2,1-3H3,(H,22,24).
What are the key properties of N-(3-chloro-4-methylphenyl)-3-[2-[2-methoxyethyl(methyl)amino]ethyl]benzamide?
N-(3-chloro-4-methylphenyl)-3-[2-[2-methoxyethyl(methyl)amino]ethyl]benzamide has a molecular weight of 360.89 g/mol, XLogP of 4.02, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-4-methylphenyl)-3-[2-[2-methoxyethyl(methyl)amino]ethyl]benzamide is sourced from PubChem (CID 146477217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).