2-chloro-N-[3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]benzamide

C25H19ClN2O3 — CID 1332229

IUPAC2-chloro-N-[3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]benzamide
SMILESO=C(COc1ccc2ccccc2c1)Nc1cccc(NC(=O)c2ccccc2Cl)c1
InChIInChI=1S/C25H19ClN2O3/c26-23-11-4-3-10-22(23)25(30)28-20-9-5-8-19(15-20)27-24(29)16-31-21-13-12-17-6-1-2-7-18(17)14-21/h1-15H,16H2,(H,27,29)(H,28,30)
InChIKeyKCKUWGTUNUEHPO-UHFFFAOYSA-N
MW430.89 g/mol
LogP5.76
Rot. Bonds6

About 2-chloro-N-[3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]benzamide

2-chloro-N-[3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]benzamide (PubChem CID 1332229) has the molecular formula C25H19ClN2O3 and a molecular weight of 430.89 g/mol. Its IUPAC name is 2-chloro-N-[3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]benzamide.

Molecular Properties

Compound Name2-chloro-N-[3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]benzamide
PubChem CID1332229
Molecular FormulaC25H19ClN2O3
Molecular Weight430.89 g/mol
Exact Mass430.11
IUPAC Name2-chloro-N-[3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]benzamide
SMILESO=C(COc1ccc2ccccc2c1)Nc1cccc(NC(=O)c2ccccc2Cl)c1
InChIInChI=1S/C25H19ClN2O3/c26-23-11-4-3-10-22(23)25(30)28-20-9-5-8-19(15-20)27-24(29)16-31-21-13-12-17-6-1-2-7-18(17)14-21/h1-15H,16H2,(H,27,29)(H,28,30)
InChIKeyKCKUWGTUNUEHPO-UHFFFAOYSA-N
XLogP5.76
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500430.89
LogP ≤ 55.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-[[2-(4-tert-butylphenoxy)acetyl]amino]phenyl]-2-chlorobenzamide
CID 23796445
2-chloro-N-[3-[[2-(4-nitrophenoxy)acetyl]amino]phenyl]benzamide
CID 1326900
N-naphthalen-2-yl-2-naphthalen-2-yloxyacetamide
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CID 807123
N-[3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]furan-2-carboxamide
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N-(3-aminophenyl)-2-naphthalen-2-yloxyacetamide
CID 16788601
2-chloro-N-[3-[2-(ethylamino)-2-oxoethoxy]phenyl]benzamide
CID 39044160
N-[3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]-3-phenylpropanamide
CID 17222822
3-[(2-naphthalen-2-yloxyacetyl)amino]benzoate
CID 6967346
2-[[3-[(2-naphthalen-2-yloxyacetyl)amino]benzoyl]amino]benzoic acid
CID 1107335
2-chloro-N-[3-[[2-(2-chloro-4,6-dimethylphenoxy)acetyl]amino]phenyl]benzamide
CID 3877756
N-(3-chloro-4-pyrrolidin-1-ylphenyl)-2-naphthalen-2-yloxyacetamide
CID 21212389

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]benzamide?
The IUPAC name of 2-chloro-N-[3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]benzamide (CID 1332229) is 2-chloro-N-[3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]benzamide.
What is the SMILES notation for 2-chloro-N-[3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]benzamide?
The canonical SMILES for 2-chloro-N-[3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]benzamide is O=C(COc1ccc2ccccc2c1)Nc1cccc(NC(=O)c2ccccc2Cl)c1.
What is the InChIKey of 2-chloro-N-[3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]benzamide?
The InChIKey is KCKUWGTUNUEHPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H19ClN2O3/c26-23-11-4-3-10-22(23)25(30)28-20-9-5-8-19(15-20)27-24(29)16-31-21-13-12-17-6-1-2-7-18(17)14-21/h1-15H,16H2,(H,27,29)(H,28,30).
What are the key properties of 2-chloro-N-[3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]benzamide?
2-chloro-N-[3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]benzamide has a molecular weight of 430.89 g/mol, XLogP of 5.76, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]benzamide is sourced from PubChem (CID 1332229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).