N-[(R)-cyclopentyl(phenyl)methyl]-2-naphthalen-1-ylacetamide

C24H25NO — CID 2203053

IUPACN-[(R)-cyclopentyl(phenyl)methyl]-2-naphthalen-1-ylacetamide
SMILESO=C(Cc1cccc2ccccc12)N[C@@H](c1ccccc1)C1CCCC1
InChIInChI=1S/C24H25NO/c26-23(17-21-15-8-14-18-9-6-7-16-22(18)21)25-24(20-12-4-5-13-20)19-10-2-1-3-11-19/h1-3,6-11,14-16,20,24H,4-5,12-13,17H2,(H,25,26)/t24-/m0/s1
InChIKeyMMQSIRAWAYWGKH-DEOSSOPVSA-N
MW343.47 g/mol
LogP5.43
Rot. Bonds5

About N-[(R)-cyclopentyl(phenyl)methyl]-2-naphthalen-1-ylacetamide

N-[(R)-cyclopentyl(phenyl)methyl]-2-naphthalen-1-ylacetamide (PubChem CID 2203053) has the molecular formula C24H25NO and a molecular weight of 343.47 g/mol. Its IUPAC name is N-[(R)-cyclopentyl(phenyl)methyl]-2-naphthalen-1-ylacetamide.

Molecular Properties

Compound NameN-[(R)-cyclopentyl(phenyl)methyl]-2-naphthalen-1-ylacetamide
PubChem CID2203053
Molecular FormulaC24H25NO
Molecular Weight343.47 g/mol
Exact Mass343.19
IUPAC NameN-[(R)-cyclopentyl(phenyl)methyl]-2-naphthalen-1-ylacetamide
SMILESO=C(Cc1cccc2ccccc12)N[C@@H](c1ccccc1)C1CCCC1
InChIInChI=1S/C24H25NO/c26-23(17-21-15-8-14-18-9-6-7-16-22(18)21)25-24(20-12-4-5-13-20)19-10-2-1-3-11-19/h1-3,6-11,14-16,20,24H,4-5,12-13,17H2,(H,25,26)/t24-/m0/s1
InChIKeyMMQSIRAWAYWGKH-DEOSSOPVSA-N
XLogP5.43
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms26
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500343.47
LogP ≤ 55.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-[(R)-cyclopentyl(phenyl)methyl]-2-naphthalen-1-ylacetamide?
The IUPAC name of N-[(R)-cyclopentyl(phenyl)methyl]-2-naphthalen-1-ylacetamide (CID 2203053) is N-[(R)-cyclopentyl(phenyl)methyl]-2-naphthalen-1-ylacetamide.
What is the SMILES notation for N-[(R)-cyclopentyl(phenyl)methyl]-2-naphthalen-1-ylacetamide?
The canonical SMILES for N-[(R)-cyclopentyl(phenyl)methyl]-2-naphthalen-1-ylacetamide is O=C(Cc1cccc2ccccc12)N[C@@H](c1ccccc1)C1CCCC1.
What is the InChIKey of N-[(R)-cyclopentyl(phenyl)methyl]-2-naphthalen-1-ylacetamide?
The InChIKey is MMQSIRAWAYWGKH-DEOSSOPVSA-N. The full InChI is InChI=1S/C24H25NO/c26-23(17-21-15-8-14-18-9-6-7-16-22(18)21)25-24(20-12-4-5-13-20)19-10-2-1-3-11-19/h1-3,6-11,14-16,20,24H,4-5,12-13,17H2,(H,25,26)/t24-/m0/s1.
What are the key properties of N-[(R)-cyclopentyl(phenyl)methyl]-2-naphthalen-1-ylacetamide?
N-[(R)-cyclopentyl(phenyl)methyl]-2-naphthalen-1-ylacetamide has a molecular weight of 343.47 g/mol, XLogP of 5.43, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(R)-cyclopentyl(phenyl)methyl]-2-naphthalen-1-ylacetamide is sourced from PubChem (CID 2203053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).