N-[(2R,3R)-3-hydroxy-1,2,3,4-tetrahydronaphthalen-2-yl]benzamide

C17H17NO2 — CID 12878375

IUPACN-[(2R,3R)-3-hydroxy-1,2,3,4-tetrahydronaphthalen-2-yl]benzamide
SMILESO=C(N[C@@H]1Cc2ccccc2C[C@H]1O)c1ccccc1
InChIInChI=1S/C17H17NO2/c19-16-11-14-9-5-4-8-13(14)10-15(16)18-17(20)12-6-2-1-3-7-12/h1-9,15-16,19H,10-11H2,(H,18,20)/t15-,16-/m1/s1
InChIKeyJOLBGWRPIXPDNP-HZPDHXFCSA-N
MW267.33 g/mol
LogP1.94
Rot. Bonds2

About N-[(2R,3R)-3-hydroxy-1,2,3,4-tetrahydronaphthalen-2-yl]benzamide

N-[(2R,3R)-3-hydroxy-1,2,3,4-tetrahydronaphthalen-2-yl]benzamide (PubChem CID 12878375) has the molecular formula C17H17NO2 and a molecular weight of 267.33 g/mol. Its IUPAC name is N-[(2R,3R)-3-hydroxy-1,2,3,4-tetrahydronaphthalen-2-yl]benzamide.

Molecular Properties

Compound NameN-[(2R,3R)-3-hydroxy-1,2,3,4-tetrahydronaphthalen-2-yl]benzamide
PubChem CID12878375
Molecular FormulaC17H17NO2
Molecular Weight267.33 g/mol
Exact Mass267.13
IUPAC NameN-[(2R,3R)-3-hydroxy-1,2,3,4-tetrahydronaphthalen-2-yl]benzamide
SMILESO=C(N[C@@H]1Cc2ccccc2C[C@H]1O)c1ccccc1
InChIInChI=1S/C17H17NO2/c19-16-11-14-9-5-4-8-13(14)10-15(16)18-17(20)12-6-2-1-3-7-12/h1-9,15-16,19H,10-11H2,(H,18,20)/t15-,16-/m1/s1
InChIKeyJOLBGWRPIXPDNP-HZPDHXFCSA-N
XLogP1.94
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(2R,3R)-3-hydroxy-1,2,3,4-tetrahydronaphthalen-2-yl]benzamide?
The IUPAC name of N-[(2R,3R)-3-hydroxy-1,2,3,4-tetrahydronaphthalen-2-yl]benzamide (CID 12878375) is N-[(2R,3R)-3-hydroxy-1,2,3,4-tetrahydronaphthalen-2-yl]benzamide.
What is the SMILES notation for N-[(2R,3R)-3-hydroxy-1,2,3,4-tetrahydronaphthalen-2-yl]benzamide?
The canonical SMILES for N-[(2R,3R)-3-hydroxy-1,2,3,4-tetrahydronaphthalen-2-yl]benzamide is O=C(N[C@@H]1Cc2ccccc2C[C@H]1O)c1ccccc1.
What is the InChIKey of N-[(2R,3R)-3-hydroxy-1,2,3,4-tetrahydronaphthalen-2-yl]benzamide?
The InChIKey is JOLBGWRPIXPDNP-HZPDHXFCSA-N. The full InChI is InChI=1S/C17H17NO2/c19-16-11-14-9-5-4-8-13(14)10-15(16)18-17(20)12-6-2-1-3-7-12/h1-9,15-16,19H,10-11H2,(H,18,20)/t15-,16-/m1/s1.
What are the key properties of N-[(2R,3R)-3-hydroxy-1,2,3,4-tetrahydronaphthalen-2-yl]benzamide?
N-[(2R,3R)-3-hydroxy-1,2,3,4-tetrahydronaphthalen-2-yl]benzamide has a molecular weight of 267.33 g/mol, XLogP of 1.94, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R,3R)-3-hydroxy-1,2,3,4-tetrahydronaphthalen-2-yl]benzamide is sourced from PubChem (CID 12878375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).