2-hydroxy-3-naphthalen-1-yloxy-3-phenyl-N-propan-2-ylpropanamide

C22H23NO3 — CID 13041345

IUPAC2-hydroxy-3-naphthalen-1-yloxy-3-phenyl-N-propan-2-ylpropanamide
SMILESCC(C)NC(=O)C(O)C(Oc1cccc2ccccc12)c1ccccc1
InChIInChI=1S/C22H23NO3/c1-15(2)23-22(25)20(24)21(17-10-4-3-5-11-17)26-19-14-8-12-16-9-6-7-13-18(16)19/h3-15,20-21,24H,1-2H3,(H,23,25)
InChIKeyWAHDBOQVNNODFO-UHFFFAOYSA-N
MW349.43 g/mol
LogP3.85
Rot. Bonds6

About 2-hydroxy-3-naphthalen-1-yloxy-3-phenyl-N-propan-2-ylpropanamide

2-hydroxy-3-naphthalen-1-yloxy-3-phenyl-N-propan-2-ylpropanamide (PubChem CID 13041345) has the molecular formula C22H23NO3 and a molecular weight of 349.43 g/mol. Its IUPAC name is 2-hydroxy-3-naphthalen-1-yloxy-3-phenyl-N-propan-2-ylpropanamide.

Molecular Properties

Compound Name2-hydroxy-3-naphthalen-1-yloxy-3-phenyl-N-propan-2-ylpropanamide
PubChem CID13041345
Molecular FormulaC22H23NO3
Molecular Weight349.43 g/mol
Exact Mass349.17
IUPAC Name2-hydroxy-3-naphthalen-1-yloxy-3-phenyl-N-propan-2-ylpropanamide
SMILESCC(C)NC(=O)C(O)C(Oc1cccc2ccccc12)c1ccccc1
InChIInChI=1S/C22H23NO3/c1-15(2)23-22(25)20(24)21(17-10-4-3-5-11-17)26-19-14-8-12-16-9-6-7-13-18(16)19/h3-15,20-21,24H,1-2H3,(H,23,25)
InChIKeyWAHDBOQVNNODFO-UHFFFAOYSA-N
XLogP3.85
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.43
LogP ≤ 53.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-benzhydryl-2-naphthalen-1-yloxybutanamide
CID 46763227
2-naphthalen-1-yloxy-N-(2-phenylpropyl)butanamide
CID 133240045
2-naphthalen-1-yloxy-N-(1-phenylethyl)acetamide
CID 4513591
(2R,3R)-2-fluoro-N-methyl-3-naphthalen-1-yloxy-3-phenylpropan-1-amine;hydrochloride
CID 69274127
(2S)-N-[(1S)-1-(4-methylphenyl)ethyl]-2-naphthalen-1-yloxypropanamide
CID 28569351
(2R)-N-[(1S)-1-(4-methoxyphenyl)ethyl]-2-naphthalen-1-yloxypropanamide
CID 28633959
(2S)-N-[(1R)-1-(4-methoxyphenyl)ethyl]-2-naphthalen-1-yloxypropanamide
CID 28633960
(2S)-2-naphthalen-1-yloxypropanoyl chloride
CID 51980355
(2R)-2-naphthalen-1-yloxypropanoyl chloride
CID 51980356
2-hydroxy-3-(2-methoxyphenoxy)-N-propan-2-ylbutanamide
CID 134349437
2-[[(2R)-2-naphthalen-1-yloxybutanoyl]amino]-N-propan-2-ylbenzamide
CID 38005316
(2S)-N-(2-ethoxyphenyl)-2-naphthalen-1-yloxy-2-phenylacetamide
CID 7506073

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-3-naphthalen-1-yloxy-3-phenyl-N-propan-2-ylpropanamide?
The IUPAC name of 2-hydroxy-3-naphthalen-1-yloxy-3-phenyl-N-propan-2-ylpropanamide (CID 13041345) is 2-hydroxy-3-naphthalen-1-yloxy-3-phenyl-N-propan-2-ylpropanamide.
What is the SMILES notation for 2-hydroxy-3-naphthalen-1-yloxy-3-phenyl-N-propan-2-ylpropanamide?
The canonical SMILES for 2-hydroxy-3-naphthalen-1-yloxy-3-phenyl-N-propan-2-ylpropanamide is CC(C)NC(=O)C(O)C(Oc1cccc2ccccc12)c1ccccc1.
What is the InChIKey of 2-hydroxy-3-naphthalen-1-yloxy-3-phenyl-N-propan-2-ylpropanamide?
The InChIKey is WAHDBOQVNNODFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23NO3/c1-15(2)23-22(25)20(24)21(17-10-4-3-5-11-17)26-19-14-8-12-16-9-6-7-13-18(16)19/h3-15,20-21,24H,1-2H3,(H,23,25).
What are the key properties of 2-hydroxy-3-naphthalen-1-yloxy-3-phenyl-N-propan-2-ylpropanamide?
2-hydroxy-3-naphthalen-1-yloxy-3-phenyl-N-propan-2-ylpropanamide has a molecular weight of 349.43 g/mol, XLogP of 3.85, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-3-naphthalen-1-yloxy-3-phenyl-N-propan-2-ylpropanamide is sourced from PubChem (CID 13041345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).