(1R)-1-naphthalen-2-yl-2-(propan-2-ylamino)ethanol

C15H19NO — CID 6604181

IUPAC(1R)-1-naphthalen-2-yl-2-(propan-2-ylamino)ethanol
SMILESCC(C)NC[C@H](O)c1ccc2ccccc2c1
InChIInChI=1S/C15H19NO/c1-11(2)16-10-15(17)14-8-7-12-5-3-4-6-13(12)9-14/h3-9,11,15-17H,10H2,1-2H3/t15-/m0/s1
InChIKeyHRSANNODOVBCST-HNNXBMFYSA-N
MW229.32 g/mol
LogP2.87
Rot. Bonds4

About (1R)-1-naphthalen-2-yl-2-(propan-2-ylamino)ethanol

(1R)-1-naphthalen-2-yl-2-(propan-2-ylamino)ethanol (PubChem CID 6604181) has the molecular formula C15H19NO and a molecular weight of 229.32 g/mol. Its IUPAC name is (1R)-1-naphthalen-2-yl-2-(propan-2-ylamino)ethanol.

Molecular Properties

Compound Name(1R)-1-naphthalen-2-yl-2-(propan-2-ylamino)ethanol
PubChem CID6604181
Molecular FormulaC15H19NO
Molecular Weight229.32 g/mol
Exact Mass229.15
IUPAC Name(1R)-1-naphthalen-2-yl-2-(propan-2-ylamino)ethanol
SMILESCC(C)NC[C@H](O)c1ccc2ccccc2c1
InChIInChI=1S/C15H19NO/c1-11(2)16-10-15(17)14-8-7-12-5-3-4-6-13(12)9-14/h3-9,11,15-17H,10H2,1-2H3/t15-/m0/s1
InChIKeyHRSANNODOVBCST-HNNXBMFYSA-N
XLogP2.87
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1R)-1-naphthalen-2-yl-2-(propan-2-ylamino)ethanol?
The IUPAC name of (1R)-1-naphthalen-2-yl-2-(propan-2-ylamino)ethanol (CID 6604181) is (1R)-1-naphthalen-2-yl-2-(propan-2-ylamino)ethanol.
What is the SMILES notation for (1R)-1-naphthalen-2-yl-2-(propan-2-ylamino)ethanol?
The canonical SMILES for (1R)-1-naphthalen-2-yl-2-(propan-2-ylamino)ethanol is CC(C)NC[C@H](O)c1ccc2ccccc2c1.
What is the InChIKey of (1R)-1-naphthalen-2-yl-2-(propan-2-ylamino)ethanol?
The InChIKey is HRSANNODOVBCST-HNNXBMFYSA-N. The full InChI is InChI=1S/C15H19NO/c1-11(2)16-10-15(17)14-8-7-12-5-3-4-6-13(12)9-14/h3-9,11,15-17H,10H2,1-2H3/t15-/m0/s1.
What are the key properties of (1R)-1-naphthalen-2-yl-2-(propan-2-ylamino)ethanol?
(1R)-1-naphthalen-2-yl-2-(propan-2-ylamino)ethanol has a molecular weight of 229.32 g/mol, XLogP of 2.87, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-naphthalen-2-yl-2-(propan-2-ylamino)ethanol is sourced from PubChem (CID 6604181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).