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

C18H19NO — CID 915645

IUPACN-phenyl-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide
SMILESCC(=O)N(c1ccccc1)[C@H]1CCCc2ccccc21
InChIInChI=1S/C18H19NO/c1-14(20)19(16-10-3-2-4-11-16)18-13-7-9-15-8-5-6-12-17(15)18/h2-6,8,10-12,18H,7,9,13H2,1H3/t18-/m0/s1
InChIKeyIAXRXHBBQMGCMR-SFHVURJKSA-N
MW265.36 g/mol
LogP4.12
Rot. Bonds2

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

N-phenyl-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide (PubChem CID 915645) has the molecular formula C18H19NO and a molecular weight of 265.36 g/mol. Its IUPAC name is N-phenyl-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide.

Molecular Properties

Compound NameN-phenyl-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide
PubChem CID915645
Molecular FormulaC18H19NO
Molecular Weight265.36 g/mol
Exact Mass265.15
IUPAC NameN-phenyl-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide
SMILESCC(=O)N(c1ccccc1)[C@H]1CCCc2ccccc21
InChIInChI=1S/C18H19NO/c1-14(20)19(16-10-3-2-4-11-16)18-13-7-9-15-8-5-6-12-17(15)18/h2-6,8,10-12,18H,7,9,13H2,1H3/t18-/m0/s1
InChIKeyIAXRXHBBQMGCMR-SFHVURJKSA-N
XLogP4.12
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 54.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-phenyl-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide?
The IUPAC name of N-phenyl-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide (CID 915645) is N-phenyl-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide.
What is the SMILES notation for N-phenyl-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide?
The canonical SMILES for N-phenyl-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide is CC(=O)N(c1ccccc1)[C@H]1CCCc2ccccc21.
What is the InChIKey of N-phenyl-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide?
The InChIKey is IAXRXHBBQMGCMR-SFHVURJKSA-N. The full InChI is InChI=1S/C18H19NO/c1-14(20)19(16-10-3-2-4-11-16)18-13-7-9-15-8-5-6-12-17(15)18/h2-6,8,10-12,18H,7,9,13H2,1H3/t18-/m0/s1.
What are the key properties of N-phenyl-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide?
N-phenyl-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide has a molecular weight of 265.36 g/mol, XLogP of 4.12, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide is sourced from PubChem (CID 915645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).