4-[(4-chlorophenyl)methoxy]-N-[2-(ethylamino)ethyl]-3-methoxybenzamide

C19H23ClN2O3 — CID 119509071

IUPAC4-[(4-chlorophenyl)methoxy]-N-[2-(ethylamino)ethyl]-3-methoxybenzamide
SMILESCCNCCNC(=O)c1ccc(OCc2ccc(Cl)cc2)c(OC)c1
InChIInChI=1S/C19H23ClN2O3/c1-3-21-10-11-22-19(23)15-6-9-17(18(12-15)24-2)25-13-14-4-7-16(20)8-5-14/h4-9,12,21H,3,10-11,13H2,1-2H3,(H,22,23)
InChIKeyYZXGLEBRHFWUAW-UHFFFAOYSA-N
MW362.86 g/mol
LogP3.27
Rot. Bonds9

About 4-[(4-chlorophenyl)methoxy]-N-[2-(ethylamino)ethyl]-3-methoxybenzamide

4-[(4-chlorophenyl)methoxy]-N-[2-(ethylamino)ethyl]-3-methoxybenzamide (PubChem CID 119509071) has the molecular formula C19H23ClN2O3 and a molecular weight of 362.86 g/mol. Its IUPAC name is 4-[(4-chlorophenyl)methoxy]-N-[2-(ethylamino)ethyl]-3-methoxybenzamide.

Molecular Properties

Compound Name4-[(4-chlorophenyl)methoxy]-N-[2-(ethylamino)ethyl]-3-methoxybenzamide
PubChem CID119509071
Molecular FormulaC19H23ClN2O3
Molecular Weight362.86 g/mol
Exact Mass362.14
IUPAC Name4-[(4-chlorophenyl)methoxy]-N-[2-(ethylamino)ethyl]-3-methoxybenzamide
SMILESCCNCCNC(=O)c1ccc(OCc2ccc(Cl)cc2)c(OC)c1
InChIInChI=1S/C19H23ClN2O3/c1-3-21-10-11-22-19(23)15-6-9-17(18(12-15)24-2)25-13-14-4-7-16(20)8-5-14/h4-9,12,21H,3,10-11,13H2,1-2H3,(H,22,23)
InChIKeyYZXGLEBRHFWUAW-UHFFFAOYSA-N
XLogP3.27
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.86
LogP ≤ 53.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[2-(ethylamino)ethyl]-3,4-dimethoxybenzamide
CID 55100526
4-[(4-chlorophenyl)methoxy]-3-methoxy-N-(2-oxopropyl)benzamide
CID 158622602
4-(2-amino-2-oxoethoxy)-N-[2-(ethylamino)ethyl]-3-methoxybenzamide
CID 119505377
3,4-dimethoxy-N-[2-[(3-methoxy-4-phenylmethoxyphenyl)methylamino]ethyl]benzamide
CID 4309421
4-(2-amino-2-oxoethoxy)-N-[2-(ethylamino)ethyl]-3-methoxybenzamide;hydrochloride
CID 119505376
4-[(4-chlorophenyl)methoxy]-N-(furan-3-ylmethyl)-3-methoxybenzamide
CID 55702606
4-[(4-chlorophenyl)methoxy]-3-methoxy-N,N-dimethylbenzamide
CID 27678333
N-[2-(ethylamino)ethyl]-3-hydroxy-4-methoxybenzamide
CID 79733239
N'-(2-chlorobenzoyl)-4-[(4-chlorophenyl)methoxy]-3-methoxybenzohydrazide
CID 35929028
N-(4-acetylphenyl)-4-[(4-chlorophenyl)methoxy]-3-methoxybenzamide
CID 2282296
4-[(4-chlorophenyl)methoxy]-3-methoxy-N'-phenylbenzohydrazide
CID 78774841
4-chloro-N-[[3-methoxy-4-(pyridin-4-ylmethoxy)phenyl]methyl]benzamide
CID 55745020

Frequently Asked Questions

What is the IUPAC name of 4-[(4-chlorophenyl)methoxy]-N-[2-(ethylamino)ethyl]-3-methoxybenzamide?
The IUPAC name of 4-[(4-chlorophenyl)methoxy]-N-[2-(ethylamino)ethyl]-3-methoxybenzamide (CID 119509071) is 4-[(4-chlorophenyl)methoxy]-N-[2-(ethylamino)ethyl]-3-methoxybenzamide.
What is the SMILES notation for 4-[(4-chlorophenyl)methoxy]-N-[2-(ethylamino)ethyl]-3-methoxybenzamide?
The canonical SMILES for 4-[(4-chlorophenyl)methoxy]-N-[2-(ethylamino)ethyl]-3-methoxybenzamide is CCNCCNC(=O)c1ccc(OCc2ccc(Cl)cc2)c(OC)c1.
What is the InChIKey of 4-[(4-chlorophenyl)methoxy]-N-[2-(ethylamino)ethyl]-3-methoxybenzamide?
The InChIKey is YZXGLEBRHFWUAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23ClN2O3/c1-3-21-10-11-22-19(23)15-6-9-17(18(12-15)24-2)25-13-14-4-7-16(20)8-5-14/h4-9,12,21H,3,10-11,13H2,1-2H3,(H,22,23).
What are the key properties of 4-[(4-chlorophenyl)methoxy]-N-[2-(ethylamino)ethyl]-3-methoxybenzamide?
4-[(4-chlorophenyl)methoxy]-N-[2-(ethylamino)ethyl]-3-methoxybenzamide has a molecular weight of 362.86 g/mol, XLogP of 3.27, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-chlorophenyl)methoxy]-N-[2-(ethylamino)ethyl]-3-methoxybenzamide is sourced from PubChem (CID 119509071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).