N-[4-[(4-chlorophenyl)methoxy]phenyl]-2-(N-methylanilino)acetamide

C22H21ClN2O2 — CID 109007233

IUPACN-[4-[(4-chlorophenyl)methoxy]phenyl]-2-(N-methylanilino)acetamide
SMILESCN(CC(=O)Nc1ccc(OCc2ccc(Cl)cc2)cc1)c1ccccc1
InChIInChI=1S/C22H21ClN2O2/c1-25(20-5-3-2-4-6-20)15-22(26)24-19-11-13-21(14-12-19)27-16-17-7-9-18(23)10-8-17/h2-14H,15-16H2,1H3,(H,24,26)
InChIKeyCRIWTFUIXNUGGP-UHFFFAOYSA-N
MW380.88 g/mol
LogP4.99
Rot. Bonds7

About N-[4-[(4-chlorophenyl)methoxy]phenyl]-2-(N-methylanilino)acetamide

N-[4-[(4-chlorophenyl)methoxy]phenyl]-2-(N-methylanilino)acetamide (PubChem CID 109007233) has the molecular formula C22H21ClN2O2 and a molecular weight of 380.88 g/mol. Its IUPAC name is N-[4-[(4-chlorophenyl)methoxy]phenyl]-2-(N-methylanilino)acetamide.

Molecular Properties

Compound NameN-[4-[(4-chlorophenyl)methoxy]phenyl]-2-(N-methylanilino)acetamide
PubChem CID109007233
Molecular FormulaC22H21ClN2O2
Molecular Weight380.88 g/mol
Exact Mass380.13
IUPAC NameN-[4-[(4-chlorophenyl)methoxy]phenyl]-2-(N-methylanilino)acetamide
SMILESCN(CC(=O)Nc1ccc(OCc2ccc(Cl)cc2)cc1)c1ccccc1
InChIInChI=1S/C22H21ClN2O2/c1-25(20-5-3-2-4-6-20)15-22(26)24-19-11-13-21(14-12-19)27-16-17-7-9-18(23)10-8-17/h2-14H,15-16H2,1H3,(H,24,26)
InChIKeyCRIWTFUIXNUGGP-UHFFFAOYSA-N
XLogP4.99
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.88
LogP ≤ 54.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(4-chlorophenyl)-N-(4-phenylmethoxyphenyl)propanamide
CID 19220831
2-[acetyl(butyl)amino]-N-[4-[(4-chlorophenyl)methoxy]phenyl]acetamide
CID 113158789
2-(N-methylanilino)-N-[4-(phenylcarbamoylamino)phenyl]acetamide
CID 32735641
4-(4-chlorophenyl)-4-oxo-N-(4-phenylmethoxyphenyl)butanamide
CID 2400388
1-(4-chlorophenyl)-N-(4-phenylmethoxyphenyl)cyclopropane-1-carboxamide
CID 2525284
2-[benzenesulfonyl(methyl)amino]-N-(4-phenylmethoxyphenyl)acetamide
CID 4241588
2-chloro-N-[4-(phenoxymethyl)phenyl]acetamide
CID 82108856
2-[(4-tert-butylphenyl)methyl-methylamino]-N-(4-phenylmethoxyphenyl)acetamide
CID 2552725
N-[2-(3-chloroanilino)-2-oxoethyl]-N-methyl-4-phenylmethoxybenzamide
CID 33284692
N-(4-chlorophenyl)-2-[methyl(3-phenoxypropyl)amino]acetamide
CID 9040068
2-[acetyl(benzyl)amino]-N-(4-phenylmethoxyphenyl)acetamide
CID 113161318
2-[[2-(4-chloroanilino)-2-oxoethyl]-methylamino]-N-(4-ethoxyphenyl)acetamide
CID 9167171

Frequently Asked Questions

What is the IUPAC name of N-[4-[(4-chlorophenyl)methoxy]phenyl]-2-(N-methylanilino)acetamide?
The IUPAC name of N-[4-[(4-chlorophenyl)methoxy]phenyl]-2-(N-methylanilino)acetamide (CID 109007233) is N-[4-[(4-chlorophenyl)methoxy]phenyl]-2-(N-methylanilino)acetamide.
What is the SMILES notation for N-[4-[(4-chlorophenyl)methoxy]phenyl]-2-(N-methylanilino)acetamide?
The canonical SMILES for N-[4-[(4-chlorophenyl)methoxy]phenyl]-2-(N-methylanilino)acetamide is CN(CC(=O)Nc1ccc(OCc2ccc(Cl)cc2)cc1)c1ccccc1.
What is the InChIKey of N-[4-[(4-chlorophenyl)methoxy]phenyl]-2-(N-methylanilino)acetamide?
The InChIKey is CRIWTFUIXNUGGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21ClN2O2/c1-25(20-5-3-2-4-6-20)15-22(26)24-19-11-13-21(14-12-19)27-16-17-7-9-18(23)10-8-17/h2-14H,15-16H2,1H3,(H,24,26).
What are the key properties of N-[4-[(4-chlorophenyl)methoxy]phenyl]-2-(N-methylanilino)acetamide?
N-[4-[(4-chlorophenyl)methoxy]phenyl]-2-(N-methylanilino)acetamide has a molecular weight of 380.88 g/mol, XLogP of 4.99, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(4-chlorophenyl)methoxy]phenyl]-2-(N-methylanilino)acetamide is sourced from PubChem (CID 109007233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).