N-(5-chloro-2-morpholin-4-ylphenyl)-3,5-dimethoxybenzamide

C19H21ClN2O4 — CID 4034494

IUPACN-(5-chloro-2-morpholin-4-ylphenyl)-3,5-dimethoxybenzamide
SMILESCOc1cc(OC)cc(C(=O)Nc2cc(Cl)ccc2N2CCOCC2)c1
InChIInChI=1S/C19H21ClN2O4/c1-24-15-9-13(10-16(12-15)25-2)19(23)21-17-11-14(20)3-4-18(17)22-5-7-26-8-6-22/h3-4,9-12H,5-8H2,1-2H3,(H,21,23)
InChIKeyFRCJGZNUZQQFEJ-UHFFFAOYSA-N
MW376.84 g/mol
LogP3.45
Rot. Bonds5

About N-(5-chloro-2-morpholin-4-ylphenyl)-3,5-dimethoxybenzamide

N-(5-chloro-2-morpholin-4-ylphenyl)-3,5-dimethoxybenzamide (PubChem CID 4034494) has the molecular formula C19H21ClN2O4 and a molecular weight of 376.84 g/mol. Its IUPAC name is N-(5-chloro-2-morpholin-4-ylphenyl)-3,5-dimethoxybenzamide.

Molecular Properties

Compound NameN-(5-chloro-2-morpholin-4-ylphenyl)-3,5-dimethoxybenzamide
PubChem CID4034494
Molecular FormulaC19H21ClN2O4
Molecular Weight376.84 g/mol
Exact Mass376.12
IUPAC NameN-(5-chloro-2-morpholin-4-ylphenyl)-3,5-dimethoxybenzamide
SMILESCOc1cc(OC)cc(C(=O)Nc2cc(Cl)ccc2N2CCOCC2)c1
InChIInChI=1S/C19H21ClN2O4/c1-24-15-9-13(10-16(12-15)25-2)19(23)21-17-11-14(20)3-4-18(17)22-5-7-26-8-6-22/h3-4,9-12H,5-8H2,1-2H3,(H,21,23)
InChIKeyFRCJGZNUZQQFEJ-UHFFFAOYSA-N
XLogP3.45
TPSA60.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.84
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[5-chloro-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3,5-dimethoxybenzamide
CID 7491968
3-chloro-N-(5-chloro-2-morpholin-4-ylphenyl)benzamide
CID 5096755
N-(5-chloro-2-morpholin-4-ylphenyl)-2-(4-methoxyphenoxy)acetamide
CID 1094305
N-(5-chloro-2-morpholin-4-ylphenyl)-3-fluorobenzamide
CID 952445
4-fluoro-N-(5-methoxy-2-morpholin-4-ylphenyl)benzamide
CID 6473304
methyl 3-[(3,5-dichloro-4-methoxybenzoyl)amino]-4-morpholin-4-ylbenzoate
CID 17336629
N-(5-fluoro-2-morpholin-4-ylphenyl)-3-methoxybenzamide
CID 113092691
N-(5-methoxy-2-morpholin-4-ylphenyl)-3,4-dimethylbenzamide
CID 17027218
4-chloro-N-(5-chloro-2-morpholin-4-ylphenyl)-2-iodobenzamide
CID 38910526
4-chloro-N-(5-chloro-2-morpholin-4-ylphenyl)-3-methylsulfonylbenzamide
CID 26207980
5-(4-chlorophenyl)-N-(5-methoxy-2-morpholin-4-ylphenyl)furan-2-carboxamide
CID 17354423
4,5-dichloro-N-(5-chloro-2-morpholin-4-ylphenyl)-1-methylpyrrole-2-carboxamide
CID 55666325

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-morpholin-4-ylphenyl)-3,5-dimethoxybenzamide?
The IUPAC name of N-(5-chloro-2-morpholin-4-ylphenyl)-3,5-dimethoxybenzamide (CID 4034494) is N-(5-chloro-2-morpholin-4-ylphenyl)-3,5-dimethoxybenzamide.
What is the SMILES notation for N-(5-chloro-2-morpholin-4-ylphenyl)-3,5-dimethoxybenzamide?
The canonical SMILES for N-(5-chloro-2-morpholin-4-ylphenyl)-3,5-dimethoxybenzamide is COc1cc(OC)cc(C(=O)Nc2cc(Cl)ccc2N2CCOCC2)c1.
What is the InChIKey of N-(5-chloro-2-morpholin-4-ylphenyl)-3,5-dimethoxybenzamide?
The InChIKey is FRCJGZNUZQQFEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21ClN2O4/c1-24-15-9-13(10-16(12-15)25-2)19(23)21-17-11-14(20)3-4-18(17)22-5-7-26-8-6-22/h3-4,9-12H,5-8H2,1-2H3,(H,21,23).
What are the key properties of N-(5-chloro-2-morpholin-4-ylphenyl)-3,5-dimethoxybenzamide?
N-(5-chloro-2-morpholin-4-ylphenyl)-3,5-dimethoxybenzamide has a molecular weight of 376.84 g/mol, XLogP of 3.45, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-morpholin-4-ylphenyl)-3,5-dimethoxybenzamide is sourced from PubChem (CID 4034494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).