N-[4-[(2-chlorophenyl)methylamino]phenyl]-2-methoxyacetamide

C16H17ClN2O2 — CID 43717390

IUPACN-[4-[(2-chlorophenyl)methylamino]phenyl]-2-methoxyacetamide
SMILESCOCC(=O)Nc1ccc(NCc2ccccc2Cl)cc1
InChIInChI=1S/C16H17ClN2O2/c1-21-11-16(20)19-14-8-6-13(7-9-14)18-10-12-4-2-3-5-15(12)17/h2-9,18H,10-11H2,1H3,(H,19,20)
InChIKeyQKUGZPWHQZCRPL-UHFFFAOYSA-N
MW304.78 g/mol
LogP3.54
Rot. Bonds6

About N-[4-[(2-chlorophenyl)methylamino]phenyl]-2-methoxyacetamide

N-[4-[(2-chlorophenyl)methylamino]phenyl]-2-methoxyacetamide (PubChem CID 43717390) has the molecular formula C16H17ClN2O2 and a molecular weight of 304.78 g/mol. Its IUPAC name is N-[4-[(2-chlorophenyl)methylamino]phenyl]-2-methoxyacetamide.

Molecular Properties

Compound NameN-[4-[(2-chlorophenyl)methylamino]phenyl]-2-methoxyacetamide
PubChem CID43717390
Molecular FormulaC16H17ClN2O2
Molecular Weight304.78 g/mol
Exact Mass304.10
IUPAC NameN-[4-[(2-chlorophenyl)methylamino]phenyl]-2-methoxyacetamide
SMILESCOCC(=O)Nc1ccc(NCc2ccccc2Cl)cc1
InChIInChI=1S/C16H17ClN2O2/c1-21-11-16(20)19-14-8-6-13(7-9-14)18-10-12-4-2-3-5-15(12)17/h2-9,18H,10-11H2,1H3,(H,19,20)
InChIKeyQKUGZPWHQZCRPL-UHFFFAOYSA-N
XLogP3.54
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.78
LogP ≤ 53.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-[(2-chlorophenyl)methylamino]phenyl]-2-phenylacetamide
CID 112982542
N-[4-[[2-[(2-chlorophenyl)methylsulfanyl]acetyl]amino]phenyl]-2-methoxyacetamide
CID 38328922
1-[4-[(2-chlorophenyl)methylamino]phenyl]ethanone
CID 82095831
N-[(2-chlorophenyl)methyl]-4-(2-methoxyethoxy)aniline
CID 43734126
N-(2-chlorophenyl)-4-[(2-methoxyacetyl)amino]benzamide
CID 1228428
N-[4-[(4-hydroxyphenyl)methylamino]phenyl]-2-methoxyacetamide
CID 43717389
2-(2-methoxyphenoxy)-N-[4-[(2-methoxyphenyl)methylamino]phenyl]acetamide
CID 112982660
N-[4-[[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]amino]phenyl]propanamide
CID 54835495
2-(2-chloro-6-fluorophenyl)-N-[4-[(2-methoxyacetyl)amino]phenyl]acetamide
CID 35332134
N-[4-[(2,4-dichlorophenyl)methylcarbamoylamino]phenyl]-2-methoxyacetamide
CID 55697658
N-[3-[(2-aminophenyl)methylamino]phenyl]-2-methoxyacetamide
CID 66387466
4-[(2-chlorophenyl)methylamino]phenol
CID 18778398

Frequently Asked Questions

What is the IUPAC name of N-[4-[(2-chlorophenyl)methylamino]phenyl]-2-methoxyacetamide?
The IUPAC name of N-[4-[(2-chlorophenyl)methylamino]phenyl]-2-methoxyacetamide (CID 43717390) is N-[4-[(2-chlorophenyl)methylamino]phenyl]-2-methoxyacetamide.
What is the SMILES notation for N-[4-[(2-chlorophenyl)methylamino]phenyl]-2-methoxyacetamide?
The canonical SMILES for N-[4-[(2-chlorophenyl)methylamino]phenyl]-2-methoxyacetamide is COCC(=O)Nc1ccc(NCc2ccccc2Cl)cc1.
What is the InChIKey of N-[4-[(2-chlorophenyl)methylamino]phenyl]-2-methoxyacetamide?
The InChIKey is QKUGZPWHQZCRPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17ClN2O2/c1-21-11-16(20)19-14-8-6-13(7-9-14)18-10-12-4-2-3-5-15(12)17/h2-9,18H,10-11H2,1H3,(H,19,20).
What are the key properties of N-[4-[(2-chlorophenyl)methylamino]phenyl]-2-methoxyacetamide?
N-[4-[(2-chlorophenyl)methylamino]phenyl]-2-methoxyacetamide has a molecular weight of 304.78 g/mol, XLogP of 3.54, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(2-chlorophenyl)methylamino]phenyl]-2-methoxyacetamide is sourced from PubChem (CID 43717390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).