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

C25H25NO3 — CID 42627881

IUPAC2-phenoxy-N-[(1R,2R)-2-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide
SMILESO=C(COc1ccccc1)N[C@@H]1c2ccccc2CC[C@H]1OCc1ccccc1
InChIInChI=1S/C25H25NO3/c27-24(18-28-21-12-5-2-6-13-21)26-25-22-14-8-7-11-20(22)15-16-23(25)29-17-19-9-3-1-4-10-19/h1-14,23,25H,15-18H2,(H,26,27)/t23-,25-/m1/s1
InChIKeyNUDBCJOKPRVDOA-ILBGXUMGSA-N
MW387.48 g/mol
LogP4.45
Rot. Bonds7

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

2-phenoxy-N-[(1R,2R)-2-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide (PubChem CID 42627881) has the molecular formula C25H25NO3 and a molecular weight of 387.48 g/mol. Its IUPAC name is 2-phenoxy-N-[(1R,2R)-2-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide.

Molecular Properties

Compound Name2-phenoxy-N-[(1R,2R)-2-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide
PubChem CID42627881
Molecular FormulaC25H25NO3
Molecular Weight387.48 g/mol
Exact Mass387.18
IUPAC Name2-phenoxy-N-[(1R,2R)-2-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide
SMILESO=C(COc1ccccc1)N[C@@H]1c2ccccc2CC[C@H]1OCc1ccccc1
InChIInChI=1S/C25H25NO3/c27-24(18-28-21-12-5-2-6-13-21)26-25-22-14-8-7-11-20(22)15-16-23(25)29-17-19-9-3-1-4-10-19/h1-14,23,25H,15-18H2,(H,26,27)/t23-,25-/m1/s1
InChIKeyNUDBCJOKPRVDOA-ILBGXUMGSA-N
XLogP4.45
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.48
LogP ≤ 54.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-phenoxy-N-[(1R,2R)-2-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide?
The IUPAC name of 2-phenoxy-N-[(1R,2R)-2-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide (CID 42627881) is 2-phenoxy-N-[(1R,2R)-2-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide.
What is the SMILES notation for 2-phenoxy-N-[(1R,2R)-2-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide?
The canonical SMILES for 2-phenoxy-N-[(1R,2R)-2-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide is O=C(COc1ccccc1)N[C@@H]1c2ccccc2CC[C@H]1OCc1ccccc1.
What is the InChIKey of 2-phenoxy-N-[(1R,2R)-2-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide?
The InChIKey is NUDBCJOKPRVDOA-ILBGXUMGSA-N. The full InChI is InChI=1S/C25H25NO3/c27-24(18-28-21-12-5-2-6-13-21)26-25-22-14-8-7-11-20(22)15-16-23(25)29-17-19-9-3-1-4-10-19/h1-14,23,25H,15-18H2,(H,26,27)/t23-,25-/m1/s1.
What are the key properties of 2-phenoxy-N-[(1R,2R)-2-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide?
2-phenoxy-N-[(1R,2R)-2-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide has a molecular weight of 387.48 g/mol, XLogP of 4.45, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenoxy-N-[(1R,2R)-2-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide is sourced from PubChem (CID 42627881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).