2-[benzyl-(2-naphthalen-1-yloxyacetyl)amino]-N-propylpropanamide

C25H28N2O3 — CID 132662254

IUPAC2-[benzyl-(2-naphthalen-1-yloxyacetyl)amino]-N-propylpropanamide
SMILESCCCNC(=O)C(C)N(Cc1ccccc1)C(=O)COc1cccc2ccccc12
InChIInChI=1S/C25H28N2O3/c1-3-16-26-25(29)19(2)27(17-20-10-5-4-6-11-20)24(28)18-30-23-15-9-13-21-12-7-8-14-22(21)23/h4-15,19H,3,16-18H2,1-2H3,(H,26,29)
InChIKeyURVQSYFBCFOYEL-UHFFFAOYSA-N
MW404.51 g/mol
LogP4.16
Rot. Bonds9

About 2-[benzyl-(2-naphthalen-1-yloxyacetyl)amino]-N-propylpropanamide

2-[benzyl-(2-naphthalen-1-yloxyacetyl)amino]-N-propylpropanamide (PubChem CID 132662254) has the molecular formula C25H28N2O3 and a molecular weight of 404.51 g/mol. Its IUPAC name is 2-[benzyl-(2-naphthalen-1-yloxyacetyl)amino]-N-propylpropanamide.

Molecular Properties

Compound Name2-[benzyl-(2-naphthalen-1-yloxyacetyl)amino]-N-propylpropanamide
PubChem CID132662254
Molecular FormulaC25H28N2O3
Molecular Weight404.51 g/mol
Exact Mass404.21
IUPAC Name2-[benzyl-(2-naphthalen-1-yloxyacetyl)amino]-N-propylpropanamide
SMILESCCCNC(=O)C(C)N(Cc1ccccc1)C(=O)COc1cccc2ccccc12
InChIInChI=1S/C25H28N2O3/c1-3-16-26-25(29)19(2)27(17-20-10-5-4-6-11-20)24(28)18-30-23-15-9-13-21-12-7-8-14-22(21)23/h4-15,19H,3,16-18H2,1-2H3,(H,26,29)
InChIKeyURVQSYFBCFOYEL-UHFFFAOYSA-N
XLogP4.16
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.51
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(3-bromophenyl)methyl-(2-naphthalen-1-yloxyacetyl)amino]-N-propylpropanamide
CID 132617171
(2S)-2-[(3-methoxyphenyl)methyl-(2-naphthalen-1-yloxyacetyl)amino]-N-propylpropanamide
CID 100521307
2-[(2,4-dichlorophenyl)methyl-(2-naphthalen-1-yloxyacetyl)amino]-N-propylpropanamide
CID 132943490
2-[(4-chlorophenyl)methyl-(2-naphthalen-1-yloxyacetyl)amino]-3-phenyl-N-propylpropanamide
CID 132621350
(2R)-2-[benzyl-(2-naphthalen-1-yloxyacetyl)amino]-N-propan-2-ylbutanamide
CID 100732305
(2S)-2-[benzyl-(2-naphthalen-1-yloxyacetyl)amino]-N-propan-2-ylbutanamide
CID 100732293
(2R)-2-[[2-(2-methoxyphenoxy)acetyl]-[(4-methoxyphenyl)methyl]amino]-N-propylpropanamide
CID 100523170
(2S)-2-[(4-fluorophenyl)methyl-(2-naphthalen-1-yloxyacetyl)amino]-N-propan-2-ylpropanamide
CID 100688812
(2R)-2-[(3-bromophenyl)methyl-(2-naphthalen-1-yloxyacetyl)amino]-N-(2-methylpropyl)propanamide
CID 100729424
2-[benzyl-[2-(2-fluorophenoxy)acetyl]amino]-N-butylpropanamide
CID 132703567
(2R)-N-[(2R)-butan-2-yl]-2-[(4-methoxyphenyl)methyl-(2-naphthalen-1-yloxyacetyl)amino]propanamide
CID 100619382
2-[(4-fluorophenyl)methyl-(2-phenoxyacetyl)amino]-N-propylpropanamide
CID 132655908

Frequently Asked Questions

What is the IUPAC name of 2-[benzyl-(2-naphthalen-1-yloxyacetyl)amino]-N-propylpropanamide?
The IUPAC name of 2-[benzyl-(2-naphthalen-1-yloxyacetyl)amino]-N-propylpropanamide (CID 132662254) is 2-[benzyl-(2-naphthalen-1-yloxyacetyl)amino]-N-propylpropanamide.
What is the SMILES notation for 2-[benzyl-(2-naphthalen-1-yloxyacetyl)amino]-N-propylpropanamide?
The canonical SMILES for 2-[benzyl-(2-naphthalen-1-yloxyacetyl)amino]-N-propylpropanamide is CCCNC(=O)C(C)N(Cc1ccccc1)C(=O)COc1cccc2ccccc12.
What is the InChIKey of 2-[benzyl-(2-naphthalen-1-yloxyacetyl)amino]-N-propylpropanamide?
The InChIKey is URVQSYFBCFOYEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H28N2O3/c1-3-16-26-25(29)19(2)27(17-20-10-5-4-6-11-20)24(28)18-30-23-15-9-13-21-12-7-8-14-22(21)23/h4-15,19H,3,16-18H2,1-2H3,(H,26,29).
What are the key properties of 2-[benzyl-(2-naphthalen-1-yloxyacetyl)amino]-N-propylpropanamide?
2-[benzyl-(2-naphthalen-1-yloxyacetyl)amino]-N-propylpropanamide has a molecular weight of 404.51 g/mol, XLogP of 4.16, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[benzyl-(2-naphthalen-1-yloxyacetyl)amino]-N-propylpropanamide is sourced from PubChem (CID 132662254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).