(4R)-4-amino-3,4-dihydro-2H-naphthalen-1-one

C10H11NO — CID 66926982

IUPAC(4R)-4-amino-3,4-dihydro-2H-naphthalen-1-one
SMILESN[C@@H]1CCC(=O)c2ccccc21
InChIInChI=1S/C10H11NO/c11-9-5-6-10(12)8-4-2-1-3-7(8)9/h1-4,9H,5-6,11H2/t9-/m1/s1
InChIKeyZIKUGMFMPBBBDM-SECBINFHSA-N
MW161.20 g/mol
LogP1.66
Rot. Bonds

About (4R)-4-amino-3,4-dihydro-2H-naphthalen-1-one

(4R)-4-amino-3,4-dihydro-2H-naphthalen-1-one (PubChem CID 66926982) has the molecular formula C10H11NO and a molecular weight of 161.20 g/mol. Its IUPAC name is (4R)-4-amino-3,4-dihydro-2H-naphthalen-1-one.

Molecular Properties

Compound Name(4R)-4-amino-3,4-dihydro-2H-naphthalen-1-one
PubChem CID66926982
Molecular FormulaC10H11NO
Molecular Weight161.20 g/mol
Exact Mass161.08
IUPAC Name(4R)-4-amino-3,4-dihydro-2H-naphthalen-1-one
SMILESN[C@@H]1CCC(=O)c2ccccc21
InChIInChI=1S/C10H11NO/c11-9-5-6-10(12)8-4-2-1-3-7(8)9/h1-4,9H,5-6,11H2/t9-/m1/s1
InChIKeyZIKUGMFMPBBBDM-SECBINFHSA-N
XLogP1.66
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.20
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4R)-4-amino-3,4-dihydro-2H-naphthalen-1-one?
The IUPAC name of (4R)-4-amino-3,4-dihydro-2H-naphthalen-1-one (CID 66926982) is (4R)-4-amino-3,4-dihydro-2H-naphthalen-1-one.
What is the SMILES notation for (4R)-4-amino-3,4-dihydro-2H-naphthalen-1-one?
The canonical SMILES for (4R)-4-amino-3,4-dihydro-2H-naphthalen-1-one is N[C@@H]1CCC(=O)c2ccccc21.
What is the InChIKey of (4R)-4-amino-3,4-dihydro-2H-naphthalen-1-one?
The InChIKey is ZIKUGMFMPBBBDM-SECBINFHSA-N. The full InChI is InChI=1S/C10H11NO/c11-9-5-6-10(12)8-4-2-1-3-7(8)9/h1-4,9H,5-6,11H2/t9-/m1/s1.
What are the key properties of (4R)-4-amino-3,4-dihydro-2H-naphthalen-1-one?
(4R)-4-amino-3,4-dihydro-2H-naphthalen-1-one has a molecular weight of 161.20 g/mol, XLogP of 1.66, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-amino-3,4-dihydro-2H-naphthalen-1-one is sourced from PubChem (CID 66926982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).