3-chloro-4-ethoxy-5-methoxy-N-(1-pyridin-2-ylethyl)benzamide

C17H19ClN2O3 — CID 43007006

IUPAC3-chloro-4-ethoxy-5-methoxy-N-(1-pyridin-2-ylethyl)benzamide
SMILESCCOc1c(Cl)cc(C(=O)NC(C)c2ccccn2)cc1OC
InChIInChI=1S/C17H19ClN2O3/c1-4-23-16-13(18)9-12(10-15(16)22-3)17(21)20-11(2)14-7-5-6-8-19-14/h5-11H,4H2,1-3H3,(H,20,21)
InChIKeyPHPZBLURWDLOSD-UHFFFAOYSA-N
MW334.80 g/mol
LogP3.63
Rot. Bonds6

About 3-chloro-4-ethoxy-5-methoxy-N-(1-pyridin-2-ylethyl)benzamide

3-chloro-4-ethoxy-5-methoxy-N-(1-pyridin-2-ylethyl)benzamide (PubChem CID 43007006) has the molecular formula C17H19ClN2O3 and a molecular weight of 334.80 g/mol. Its IUPAC name is 3-chloro-4-ethoxy-5-methoxy-N-(1-pyridin-2-ylethyl)benzamide.

Molecular Properties

Compound Name3-chloro-4-ethoxy-5-methoxy-N-(1-pyridin-2-ylethyl)benzamide
PubChem CID43007006
Molecular FormulaC17H19ClN2O3
Molecular Weight334.80 g/mol
Exact Mass334.11
IUPAC Name3-chloro-4-ethoxy-5-methoxy-N-(1-pyridin-2-ylethyl)benzamide
SMILESCCOc1c(Cl)cc(C(=O)NC(C)c2ccccn2)cc1OC
InChIInChI=1S/C17H19ClN2O3/c1-4-23-16-13(18)9-12(10-15(16)22-3)17(21)20-11(2)14-7-5-6-8-19-14/h5-11H,4H2,1-3H3,(H,20,21)
InChIKeyPHPZBLURWDLOSD-UHFFFAOYSA-N
XLogP3.63
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.80
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-chloro-4-ethoxy-5-methoxy-N-(1-pyridin-2-ylethyl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-chloro-4-ethoxy-5-methoxy-N-[1-(3,4,5-trimethoxyphenyl)ethyl]benzamide
CID 55709358
3-chloro-N-[1-(3-chlorophenyl)ethyl]-4-ethoxy-5-methoxybenzamide
CID 43010464
3-chloro-4-ethoxy-5-methoxy-N-[phenyl(pyridin-4-yl)methyl]benzamide
CID 86978352
4-(2-amino-2-oxoethoxy)-3-chloro-5-methoxy-N-[1-(2-methoxyphenyl)ethyl]benzamide
CID 17442232
3-methoxy-4-(2-methylpropoxy)-N-(1-pyridin-2-ylethyl)benzamide
CID 112758953
4-amino-3-chloro-N-[(1R)-1-pyridin-2-ylethyl]benzamide
CID 81407020
3-bromo-5-chloro-N-(1-pyridin-2-ylethyl)benzamide
CID 103826399
4-hexoxy-3-methoxy-N-(1-pyridin-2-ylethyl)benzamide
CID 55334786
N-tert-butyl-3-chloro-4-ethoxy-5-methoxybenzamide
CID 51149799
3-chloro-4-ethoxy-N-ethyl-5-methoxybenzamide
CID 4019804
3-chloro-4-ethoxy-5-methoxy-N-(2-methylphenyl)benzamide
CID 3944702
3-chloro-4-ethoxy-5-methoxy-N-pyridin-3-ylbenzamide
CID 25343284

Frequently Asked Questions

What is the IUPAC name of 3-chloro-4-ethoxy-5-methoxy-N-(1-pyridin-2-ylethyl)benzamide?
The IUPAC name of 3-chloro-4-ethoxy-5-methoxy-N-(1-pyridin-2-ylethyl)benzamide (CID 43007006) is 3-chloro-4-ethoxy-5-methoxy-N-(1-pyridin-2-ylethyl)benzamide.
What is the SMILES notation for 3-chloro-4-ethoxy-5-methoxy-N-(1-pyridin-2-ylethyl)benzamide?
The canonical SMILES for 3-chloro-4-ethoxy-5-methoxy-N-(1-pyridin-2-ylethyl)benzamide is CCOc1c(Cl)cc(C(=O)NC(C)c2ccccn2)cc1OC.
What is the InChIKey of 3-chloro-4-ethoxy-5-methoxy-N-(1-pyridin-2-ylethyl)benzamide?
The InChIKey is PHPZBLURWDLOSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19ClN2O3/c1-4-23-16-13(18)9-12(10-15(16)22-3)17(21)20-11(2)14-7-5-6-8-19-14/h5-11H,4H2,1-3H3,(H,20,21).
What are the key properties of 3-chloro-4-ethoxy-5-methoxy-N-(1-pyridin-2-ylethyl)benzamide?
3-chloro-4-ethoxy-5-methoxy-N-(1-pyridin-2-ylethyl)benzamide has a molecular weight of 334.80 g/mol, XLogP of 3.63, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-4-ethoxy-5-methoxy-N-(1-pyridin-2-ylethyl)benzamide is sourced from PubChem (CID 43007006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).