2-phenyl-N-[(1R,2S)-2-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide

C25H25NO2 — CID 42627899

IUPAC2-phenyl-N-[(1R,2S)-2-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide
SMILESO=C(Cc1ccccc1)N[C@@H]1c2ccccc2CC[C@@H]1OCc1ccccc1
InChIInChI=1S/C25H25NO2/c27-24(17-19-9-3-1-4-10-19)26-25-22-14-8-7-13-21(22)15-16-23(25)28-18-20-11-5-2-6-12-20/h1-14,23,25H,15-18H2,(H,26,27)/t23-,25+/m0/s1
InChIKeyDTNFWNYINOXANE-UKILVPOCSA-N
MW371.48 g/mol
LogP4.62
Rot. Bonds6

About 2-phenyl-N-[(1R,2S)-2-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide

2-phenyl-N-[(1R,2S)-2-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide (PubChem CID 42627899) has the molecular formula C25H25NO2 and a molecular weight of 371.48 g/mol. Its IUPAC name is 2-phenyl-N-[(1R,2S)-2-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide.

Molecular Properties

Compound Name2-phenyl-N-[(1R,2S)-2-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide
PubChem CID42627899
Molecular FormulaC25H25NO2
Molecular Weight371.48 g/mol
Exact Mass371.19
IUPAC Name2-phenyl-N-[(1R,2S)-2-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide
SMILESO=C(Cc1ccccc1)N[C@@H]1c2ccccc2CC[C@@H]1OCc1ccccc1
InChIInChI=1S/C25H25NO2/c27-24(17-19-9-3-1-4-10-19)26-25-22-14-8-7-13-21(22)15-16-23(25)28-18-20-11-5-2-6-12-20/h1-14,23,25H,15-18H2,(H,26,27)/t23-,25+/m0/s1
InChIKeyDTNFWNYINOXANE-UKILVPOCSA-N
XLogP4.62
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.48
LogP ≤ 54.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-N-[(1R,2S)-2-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide?
The IUPAC name of 2-phenyl-N-[(1R,2S)-2-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide (CID 42627899) is 2-phenyl-N-[(1R,2S)-2-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide.
What is the SMILES notation for 2-phenyl-N-[(1R,2S)-2-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide?
The canonical SMILES for 2-phenyl-N-[(1R,2S)-2-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide is O=C(Cc1ccccc1)N[C@@H]1c2ccccc2CC[C@@H]1OCc1ccccc1.
What is the InChIKey of 2-phenyl-N-[(1R,2S)-2-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide?
The InChIKey is DTNFWNYINOXANE-UKILVPOCSA-N. The full InChI is InChI=1S/C25H25NO2/c27-24(17-19-9-3-1-4-10-19)26-25-22-14-8-7-13-21(22)15-16-23(25)28-18-20-11-5-2-6-12-20/h1-14,23,25H,15-18H2,(H,26,27)/t23-,25+/m0/s1.
What are the key properties of 2-phenyl-N-[(1R,2S)-2-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide?
2-phenyl-N-[(1R,2S)-2-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide has a molecular weight of 371.48 g/mol, XLogP of 4.62, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-N-[(1R,2S)-2-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide is sourced from PubChem (CID 42627899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).