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

C20H23NO — CID 2098930

IUPAC4-propan-2-yl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide
SMILESCC(C)c1ccc(C(=O)N[C@@H]2CCCc3ccccc32)cc1
InChIInChI=1S/C20H23NO/c1-14(2)15-10-12-17(13-11-15)20(22)21-19-9-5-7-16-6-3-4-8-18(16)19/h3-4,6,8,10-14,19H,5,7,9H2,1-2H3,(H,21,22)/t19-/m1/s1
InChIKeyXGWYDWYEWZPLBD-LJQANCHMSA-N
MW293.41 g/mol
LogP4.62
Rot. Bonds3

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

4-propan-2-yl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide (PubChem CID 2098930) has the molecular formula C20H23NO and a molecular weight of 293.41 g/mol. Its IUPAC name is 4-propan-2-yl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide.

Molecular Properties

Compound Name4-propan-2-yl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide
PubChem CID2098930
Molecular FormulaC20H23NO
Molecular Weight293.41 g/mol
Exact Mass293.18
IUPAC Name4-propan-2-yl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide
SMILESCC(C)c1ccc(C(=O)N[C@@H]2CCCc3ccccc32)cc1
InChIInChI=1S/C20H23NO/c1-14(2)15-10-12-17(13-11-15)20(22)21-19-9-5-7-16-6-3-4-8-18(16)19/h3-4,6,8,10-14,19H,5,7,9H2,1-2H3,(H,21,22)/t19-/m1/s1
InChIKeyXGWYDWYEWZPLBD-LJQANCHMSA-N
XLogP4.62
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.41
LogP ≤ 54.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-propan-2-yl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide?
The IUPAC name of 4-propan-2-yl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide (CID 2098930) is 4-propan-2-yl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide.
What is the SMILES notation for 4-propan-2-yl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide?
The canonical SMILES for 4-propan-2-yl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide is CC(C)c1ccc(C(=O)N[C@@H]2CCCc3ccccc32)cc1.
What is the InChIKey of 4-propan-2-yl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide?
The InChIKey is XGWYDWYEWZPLBD-LJQANCHMSA-N. The full InChI is InChI=1S/C20H23NO/c1-14(2)15-10-12-17(13-11-15)20(22)21-19-9-5-7-16-6-3-4-8-18(16)19/h3-4,6,8,10-14,19H,5,7,9H2,1-2H3,(H,21,22)/t19-/m1/s1.
What are the key properties of 4-propan-2-yl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide?
4-propan-2-yl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide has a molecular weight of 293.41 g/mol, XLogP of 4.62, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propan-2-yl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide is sourced from PubChem (CID 2098930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).