N-(5-chloro-2-methoxyphenyl)-4-(4-methoxy-3-methylphenyl)butanamide

C19H22ClNO3 — CID 838505

IUPACN-(5-chloro-2-methoxyphenyl)-4-(4-methoxy-3-methylphenyl)butanamide
SMILESCOc1ccc(CCCC(=O)Nc2cc(Cl)ccc2OC)cc1C
InChIInChI=1S/C19H22ClNO3/c1-13-11-14(7-9-17(13)23-2)5-4-6-19(22)21-16-12-15(20)8-10-18(16)24-3/h7-12H,4-6H2,1-3H3,(H,21,22)
InChIKeyBPYXZFWAYISOTP-UHFFFAOYSA-N
MW347.84 g/mol
LogP4.63
Rot. Bonds7

About N-(5-chloro-2-methoxyphenyl)-4-(4-methoxy-3-methylphenyl)butanamide

N-(5-chloro-2-methoxyphenyl)-4-(4-methoxy-3-methylphenyl)butanamide (PubChem CID 838505) has the molecular formula C19H22ClNO3 and a molecular weight of 347.84 g/mol. Its IUPAC name is N-(5-chloro-2-methoxyphenyl)-4-(4-methoxy-3-methylphenyl)butanamide.

Molecular Properties

Compound NameN-(5-chloro-2-methoxyphenyl)-4-(4-methoxy-3-methylphenyl)butanamide
PubChem CID838505
Molecular FormulaC19H22ClNO3
Molecular Weight347.84 g/mol
Exact Mass347.13
IUPAC NameN-(5-chloro-2-methoxyphenyl)-4-(4-methoxy-3-methylphenyl)butanamide
SMILESCOc1ccc(CCCC(=O)Nc2cc(Cl)ccc2OC)cc1C
InChIInChI=1S/C19H22ClNO3/c1-13-11-14(7-9-17(13)23-2)5-4-6-19(22)21-16-12-15(20)8-10-18(16)24-3/h7-12H,4-6H2,1-3H3,(H,21,22)
InChIKeyBPYXZFWAYISOTP-UHFFFAOYSA-N
XLogP4.63
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.84
LogP ≤ 54.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[5-chloro-2-(4-methoxyphenoxy)phenyl]-3-(3,4-dimethylphenyl)propanamide
CID 100665009
5-bromo-N-(5-chloro-2-methoxyphenyl)pentanamide
CID 103601683
N-methoxy-4-(4-methoxy-3-methylphenyl)butanamide
CID 11470409
3-(4-aminophenyl)-N-(5-chloro-2-methoxyphenyl)propanamide
CID 28713135
N-(5-chloro-2-methoxyphenyl)-3-(5-chloro-2-methylanilino)propanamide
CID 109038439
N-(5-chloro-2-methoxyphenyl)-3-[2-(4-chlorophenyl)ethylamino]propanamide
CID 109028066
N-(5-chloro-2-methoxyphenyl)-4-(4-ethylphenoxy)butanamide
CID 19184672
N-(5-chloro-2-methoxyphenyl)-2-[(4-chlorophenyl)methylamino]acetamide
CID 108998151
N'-(5-chloro-2-methoxyphenyl)butanediamide
CID 94271903
ethyl 4-(5-chloro-2-methoxyanilino)-4-oxobutanoate
CID 9073367
2-chloro-N-(5-chloro-2-methoxyphenyl)acetamide
CID 776663
N-(5-chloro-2-methoxyphenyl)-5-(4-methoxyphenyl)-5-oxopentanamide
CID 55906615

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methoxyphenyl)-4-(4-methoxy-3-methylphenyl)butanamide?
The IUPAC name of N-(5-chloro-2-methoxyphenyl)-4-(4-methoxy-3-methylphenyl)butanamide (CID 838505) is N-(5-chloro-2-methoxyphenyl)-4-(4-methoxy-3-methylphenyl)butanamide.
What is the SMILES notation for N-(5-chloro-2-methoxyphenyl)-4-(4-methoxy-3-methylphenyl)butanamide?
The canonical SMILES for N-(5-chloro-2-methoxyphenyl)-4-(4-methoxy-3-methylphenyl)butanamide is COc1ccc(CCCC(=O)Nc2cc(Cl)ccc2OC)cc1C.
What is the InChIKey of N-(5-chloro-2-methoxyphenyl)-4-(4-methoxy-3-methylphenyl)butanamide?
The InChIKey is BPYXZFWAYISOTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22ClNO3/c1-13-11-14(7-9-17(13)23-2)5-4-6-19(22)21-16-12-15(20)8-10-18(16)24-3/h7-12H,4-6H2,1-3H3,(H,21,22).
What are the key properties of N-(5-chloro-2-methoxyphenyl)-4-(4-methoxy-3-methylphenyl)butanamide?
N-(5-chloro-2-methoxyphenyl)-4-(4-methoxy-3-methylphenyl)butanamide has a molecular weight of 347.84 g/mol, XLogP of 4.63, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methoxyphenyl)-4-(4-methoxy-3-methylphenyl)butanamide is sourced from PubChem (CID 838505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).