N,2-dimethyl-3-naphthalen-2-yloxypropan-1-amine

C15H19NO — CID 62459950

IUPACN,2-dimethyl-3-naphthalen-2-yloxypropan-1-amine
SMILESCNCC(C)COc1ccc2ccccc2c1
InChIInChI=1S/C15H19NO/c1-12(10-16-2)11-17-15-8-7-13-5-3-4-6-14(13)9-15/h3-9,12,16H,10-11H2,1-2H3
InChIKeyQEJUCPXLAOGZNG-UHFFFAOYSA-N
MW229.32 g/mol
LogP3.07
Rot. Bonds5

About N,2-dimethyl-3-naphthalen-2-yloxypropan-1-amine

N,2-dimethyl-3-naphthalen-2-yloxypropan-1-amine (PubChem CID 62459950) has the molecular formula C15H19NO and a molecular weight of 229.32 g/mol. Its IUPAC name is N,2-dimethyl-3-naphthalen-2-yloxypropan-1-amine.

Molecular Properties

Compound NameN,2-dimethyl-3-naphthalen-2-yloxypropan-1-amine
PubChem CID62459950
Molecular FormulaC15H19NO
Molecular Weight229.32 g/mol
Exact Mass229.15
IUPAC NameN,2-dimethyl-3-naphthalen-2-yloxypropan-1-amine
SMILESCNCC(C)COc1ccc2ccccc2c1
InChIInChI=1S/C15H19NO/c1-12(10-16-2)11-17-15-8-7-13-5-3-4-6-14(13)9-15/h3-9,12,16H,10-11H2,1-2H3
InChIKeyQEJUCPXLAOGZNG-UHFFFAOYSA-N
XLogP3.07
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-3-naphthalen-2-yloxypropan-1-amine?
The IUPAC name of N,2-dimethyl-3-naphthalen-2-yloxypropan-1-amine (CID 62459950) is N,2-dimethyl-3-naphthalen-2-yloxypropan-1-amine.
What is the SMILES notation for N,2-dimethyl-3-naphthalen-2-yloxypropan-1-amine?
The canonical SMILES for N,2-dimethyl-3-naphthalen-2-yloxypropan-1-amine is CNCC(C)COc1ccc2ccccc2c1.
What is the InChIKey of N,2-dimethyl-3-naphthalen-2-yloxypropan-1-amine?
The InChIKey is QEJUCPXLAOGZNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO/c1-12(10-16-2)11-17-15-8-7-13-5-3-4-6-14(13)9-15/h3-9,12,16H,10-11H2,1-2H3.
What are the key properties of N,2-dimethyl-3-naphthalen-2-yloxypropan-1-amine?
N,2-dimethyl-3-naphthalen-2-yloxypropan-1-amine has a molecular weight of 229.32 g/mol, XLogP of 3.07, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-3-naphthalen-2-yloxypropan-1-amine is sourced from PubChem (CID 62459950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).