(1R,2R)-3-amino-2-naphthalen-2-yl-1-phenylpropan-1-ol;hydrochloride

C19H20ClNO — CID 45265255

IUPAC(1R,2R)-3-amino-2-naphthalen-2-yl-1-phenylpropan-1-ol;hydrochloride
SMILESCl.NC[C@@H](c1ccc2ccccc2c1)[C@@H](O)c1ccccc1
InChIInChI=1S/C19H19NO.ClH/c20-13-18(19(21)15-7-2-1-3-8-15)17-11-10-14-6-4-5-9-16(14)12-17;/h1-12,18-19,21H,13,20H2;1H/t18-,19-;/m0./s1
InChIKeyGRNINAGHVYRWAO-HLRBRJAUSA-N
MW313.83 g/mol
LogP4.04
Rot. Bonds4

About (1R,2R)-3-amino-2-naphthalen-2-yl-1-phenylpropan-1-ol;hydrochloride

(1R,2R)-3-amino-2-naphthalen-2-yl-1-phenylpropan-1-ol;hydrochloride (PubChem CID 45265255) has the molecular formula C19H20ClNO and a molecular weight of 313.83 g/mol. Its IUPAC name is (1R,2R)-3-amino-2-naphthalen-2-yl-1-phenylpropan-1-ol;hydrochloride.

Molecular Properties

Compound Name(1R,2R)-3-amino-2-naphthalen-2-yl-1-phenylpropan-1-ol;hydrochloride
PubChem CID45265255
Molecular FormulaC19H20ClNO
Molecular Weight313.83 g/mol
Exact Mass313.12
IUPAC Name(1R,2R)-3-amino-2-naphthalen-2-yl-1-phenylpropan-1-ol;hydrochloride
SMILESCl.NC[C@@H](c1ccc2ccccc2c1)[C@@H](O)c1ccccc1
InChIInChI=1S/C19H19NO.ClH/c20-13-18(19(21)15-7-2-1-3-8-15)17-11-10-14-6-4-5-9-16(14)12-17;/h1-12,18-19,21H,13,20H2;1H/t18-,19-;/m0./s1
InChIKeyGRNINAGHVYRWAO-HLRBRJAUSA-N
XLogP4.04
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.83
LogP ≤ 54.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1R,2R)-3-amino-2-naphthalen-2-yl-1-phenylpropan-1-ol;hydrochloride?
The IUPAC name of (1R,2R)-3-amino-2-naphthalen-2-yl-1-phenylpropan-1-ol;hydrochloride (CID 45265255) is (1R,2R)-3-amino-2-naphthalen-2-yl-1-phenylpropan-1-ol;hydrochloride.
What is the SMILES notation for (1R,2R)-3-amino-2-naphthalen-2-yl-1-phenylpropan-1-ol;hydrochloride?
The canonical SMILES for (1R,2R)-3-amino-2-naphthalen-2-yl-1-phenylpropan-1-ol;hydrochloride is Cl.NC[C@@H](c1ccc2ccccc2c1)[C@@H](O)c1ccccc1.
What is the InChIKey of (1R,2R)-3-amino-2-naphthalen-2-yl-1-phenylpropan-1-ol;hydrochloride?
The InChIKey is GRNINAGHVYRWAO-HLRBRJAUSA-N. The full InChI is InChI=1S/C19H19NO.ClH/c20-13-18(19(21)15-7-2-1-3-8-15)17-11-10-14-6-4-5-9-16(14)12-17;/h1-12,18-19,21H,13,20H2;1H/t18-,19-;/m0./s1.
What are the key properties of (1R,2R)-3-amino-2-naphthalen-2-yl-1-phenylpropan-1-ol;hydrochloride?
(1R,2R)-3-amino-2-naphthalen-2-yl-1-phenylpropan-1-ol;hydrochloride has a molecular weight of 313.83 g/mol, XLogP of 4.04, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,2R)-3-amino-2-naphthalen-2-yl-1-phenylpropan-1-ol;hydrochloride is sourced from PubChem (CID 45265255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).