N-[(2-chlorophenyl)methyl]-2-[(2-methoxyphenyl)methylamino]acetamide

C17H19ClN2O2 — CID 108998011

IUPACN-[(2-chlorophenyl)methyl]-2-[(2-methoxyphenyl)methylamino]acetamide
SMILESCOc1ccccc1CNCC(=O)NCc1ccccc1Cl
InChIInChI=1S/C17H19ClN2O2/c1-22-16-9-5-3-7-14(16)10-19-12-17(21)20-11-13-6-2-4-8-15(13)18/h2-9,19H,10-12H2,1H3,(H,20,21)
InChIKeyNGRXLTAKYWKMGW-UHFFFAOYSA-N
MW318.80 g/mol
LogP2.75
Rot. Bonds7

About N-[(2-chlorophenyl)methyl]-2-[(2-methoxyphenyl)methylamino]acetamide

N-[(2-chlorophenyl)methyl]-2-[(2-methoxyphenyl)methylamino]acetamide (PubChem CID 108998011) has the molecular formula C17H19ClN2O2 and a molecular weight of 318.80 g/mol. Its IUPAC name is N-[(2-chlorophenyl)methyl]-2-[(2-methoxyphenyl)methylamino]acetamide.

Molecular Properties

Compound NameN-[(2-chlorophenyl)methyl]-2-[(2-methoxyphenyl)methylamino]acetamide
PubChem CID108998011
Molecular FormulaC17H19ClN2O2
Molecular Weight318.80 g/mol
Exact Mass318.11
IUPAC NameN-[(2-chlorophenyl)methyl]-2-[(2-methoxyphenyl)methylamino]acetamide
SMILESCOc1ccccc1CNCC(=O)NCc1ccccc1Cl
InChIInChI=1S/C17H19ClN2O2/c1-22-16-9-5-3-7-14(16)10-19-12-17(21)20-11-13-6-2-4-8-15(13)18/h2-9,19H,10-12H2,1H3,(H,20,21)
InChIKeyNGRXLTAKYWKMGW-UHFFFAOYSA-N
XLogP2.75
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.80
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2-chlorophenyl)methylamino]-N-[2-(2-methoxyphenyl)ethyl]acetamide
CID 108997926
2-[(2-methoxyphenyl)methylamino]-N-[(2-methylphenyl)methyl]acetamide
CID 108996645
2-anilino-N-[(2-methoxyphenyl)methyl]acetamide
CID 60646954
2-(2-chlorophenyl)sulfanyl-N-[(2-methoxyphenyl)methyl]acetamide
CID 2342913
2-[3-(dimethylamino)propylamino]-N-[(2-methoxyphenyl)methyl]acetamide
CID 108995055
N-[(2-chlorophenyl)methyl]-2-(2-methoxyethylamino)acetamide;hydrochloride
CID 119673533
N-[(2-methoxyphenyl)methyl]-2-pyrrolidin-1-ylacetamide
CID 8901770
N-[(2-chlorophenyl)methyl]-2-(2,3,4-trimethoxyphenyl)acetamide
CID 9079447
2-(tert-butylamino)-N-[(2-methoxyphenyl)methyl]acetamide
CID 78907392
3,4-dichloro-N-[2-[(2-methoxyphenyl)methylamino]-2-oxoethyl]benzamide
CID 9246284
2-(azocan-1-yl)-N-[(2-methoxyphenyl)methyl]acetamide
CID 51170947
1-[2-(2-chlorophenyl)ethyl]-3-[(2-methoxyphenyl)methyl]urea
CID 108897450

Frequently Asked Questions

What is the IUPAC name of N-[(2-chlorophenyl)methyl]-2-[(2-methoxyphenyl)methylamino]acetamide?
The IUPAC name of N-[(2-chlorophenyl)methyl]-2-[(2-methoxyphenyl)methylamino]acetamide (CID 108998011) is N-[(2-chlorophenyl)methyl]-2-[(2-methoxyphenyl)methylamino]acetamide.
What is the SMILES notation for N-[(2-chlorophenyl)methyl]-2-[(2-methoxyphenyl)methylamino]acetamide?
The canonical SMILES for N-[(2-chlorophenyl)methyl]-2-[(2-methoxyphenyl)methylamino]acetamide is COc1ccccc1CNCC(=O)NCc1ccccc1Cl.
What is the InChIKey of N-[(2-chlorophenyl)methyl]-2-[(2-methoxyphenyl)methylamino]acetamide?
The InChIKey is NGRXLTAKYWKMGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19ClN2O2/c1-22-16-9-5-3-7-14(16)10-19-12-17(21)20-11-13-6-2-4-8-15(13)18/h2-9,19H,10-12H2,1H3,(H,20,21).
What are the key properties of N-[(2-chlorophenyl)methyl]-2-[(2-methoxyphenyl)methylamino]acetamide?
N-[(2-chlorophenyl)methyl]-2-[(2-methoxyphenyl)methylamino]acetamide has a molecular weight of 318.80 g/mol, XLogP of 2.75, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-chlorophenyl)methyl]-2-[(2-methoxyphenyl)methylamino]acetamide is sourced from PubChem (CID 108998011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).