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

C27H24N2O3 — CID 17222822

IUPACN-[3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]-3-phenylpropanamide
SMILESO=C(CCc1ccccc1)Nc1cccc(NC(=O)COc2ccc3ccccc3c2)c1
InChIInChI=1S/C27H24N2O3/c30-26(16-13-20-7-2-1-3-8-20)28-23-11-6-12-24(18-23)29-27(31)19-32-25-15-14-21-9-4-5-10-22(21)17-25/h1-12,14-15,17-18H,13,16,19H2,(H,28,30)(H,29,31)
InChIKeyJNSRTYBWQZXMFK-UHFFFAOYSA-N
MW424.50 g/mol
LogP5.43
Rot. Bonds8

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

N-[3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]-3-phenylpropanamide (PubChem CID 17222822) has the molecular formula C27H24N2O3 and a molecular weight of 424.50 g/mol. Its IUPAC name is N-[3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]-3-phenylpropanamide.

Molecular Properties

Compound NameN-[3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]-3-phenylpropanamide
PubChem CID17222822
Molecular FormulaC27H24N2O3
Molecular Weight424.50 g/mol
Exact Mass424.18
IUPAC NameN-[3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]-3-phenylpropanamide
SMILESO=C(CCc1ccccc1)Nc1cccc(NC(=O)COc2ccc3ccccc3c2)c1
InChIInChI=1S/C27H24N2O3/c30-26(16-13-20-7-2-1-3-8-20)28-23-11-6-12-24(18-23)29-27(31)19-32-25-15-14-21-9-4-5-10-22(21)17-25/h1-12,14-15,17-18H,13,16,19H2,(H,28,30)(H,29,31)
InChIKeyJNSRTYBWQZXMFK-UHFFFAOYSA-N
XLogP5.43
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500424.50
LogP ≤ 55.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-naphthalen-2-yl-2-naphthalen-2-yloxyacetamide
CID 879369
N-[3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]propanamide
CID 807123
N-[3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]furan-2-carboxamide
CID 1491636
N-(3-aminophenyl)-2-naphthalen-2-yloxyacetamide
CID 16788601
2-naphthalen-2-yloxy-N-(4-phenylmethoxyphenyl)acetamide
CID 1352449
N-[3-[[2-(2-chlorophenoxy)acetyl]amino]phenyl]-3-phenylpropanamide
CID 17222861
N-[3-[[2-(4-methoxyphenyl)acetyl]amino]phenyl]-3-phenylpropanamide
CID 17222836
3-[(2-naphthalen-2-yloxyacetyl)amino]benzoate
CID 6967346
2-chloro-N-[3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]benzamide
CID 1332229
2-naphthalen-2-yloxy-N-pyridin-4-ylacetamide
CID 823638
2-phenylethyl 4-oxo-4-[3-[(2-phenoxyacetyl)amino]anilino]butanoate
CID 17231357
N-ethyl-3-[(2-naphthalen-2-yloxyacetyl)amino]benzamide
CID 17230651

Frequently Asked Questions

What is the IUPAC name of N-[3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]-3-phenylpropanamide?
The IUPAC name of N-[3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]-3-phenylpropanamide (CID 17222822) is N-[3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]-3-phenylpropanamide.
What is the SMILES notation for N-[3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]-3-phenylpropanamide?
The canonical SMILES for N-[3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]-3-phenylpropanamide is O=C(CCc1ccccc1)Nc1cccc(NC(=O)COc2ccc3ccccc3c2)c1.
What is the InChIKey of N-[3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]-3-phenylpropanamide?
The InChIKey is JNSRTYBWQZXMFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H24N2O3/c30-26(16-13-20-7-2-1-3-8-20)28-23-11-6-12-24(18-23)29-27(31)19-32-25-15-14-21-9-4-5-10-22(21)17-25/h1-12,14-15,17-18H,13,16,19H2,(H,28,30)(H,29,31).
What are the key properties of N-[3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]-3-phenylpropanamide?
N-[3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]-3-phenylpropanamide has a molecular weight of 424.50 g/mol, XLogP of 5.43, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]-3-phenylpropanamide is sourced from PubChem (CID 17222822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).