N-methyl-1-(3-naphthalen-1-yloxyphenyl)ethanamine

C19H19NO — CID 79166432

IUPACN-methyl-1-(3-naphthalen-1-yloxyphenyl)ethanamine
SMILESCNC(C)c1cccc(Oc2cccc3ccccc23)c1
InChIInChI=1S/C19H19NO/c1-14(20-2)16-9-5-10-17(13-16)21-19-12-6-8-15-7-3-4-11-18(15)19/h3-14,20H,1-2H3
InChIKeyFCVZAYCVACLXSI-UHFFFAOYSA-N
MW277.37 g/mol
LogP4.91
Rot. Bonds4

About N-methyl-1-(3-naphthalen-1-yloxyphenyl)ethanamine

N-methyl-1-(3-naphthalen-1-yloxyphenyl)ethanamine (PubChem CID 79166432) has the molecular formula C19H19NO and a molecular weight of 277.37 g/mol. Its IUPAC name is N-methyl-1-(3-naphthalen-1-yloxyphenyl)ethanamine.

Molecular Properties

Compound NameN-methyl-1-(3-naphthalen-1-yloxyphenyl)ethanamine
PubChem CID79166432
Molecular FormulaC19H19NO
Molecular Weight277.37 g/mol
Exact Mass277.15
IUPAC NameN-methyl-1-(3-naphthalen-1-yloxyphenyl)ethanamine
SMILESCNC(C)c1cccc(Oc2cccc3ccccc23)c1
InChIInChI=1S/C19H19NO/c1-14(20-2)16-9-5-10-17(13-16)21-19-12-6-8-15-7-3-4-11-18(15)19/h3-14,20H,1-2H3
InChIKeyFCVZAYCVACLXSI-UHFFFAOYSA-N
XLogP4.91
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 54.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(3-naphthalen-1-yloxyphenyl)ethanamine?
The IUPAC name of N-methyl-1-(3-naphthalen-1-yloxyphenyl)ethanamine (CID 79166432) is N-methyl-1-(3-naphthalen-1-yloxyphenyl)ethanamine.
What is the SMILES notation for N-methyl-1-(3-naphthalen-1-yloxyphenyl)ethanamine?
The canonical SMILES for N-methyl-1-(3-naphthalen-1-yloxyphenyl)ethanamine is CNC(C)c1cccc(Oc2cccc3ccccc23)c1.
What is the InChIKey of N-methyl-1-(3-naphthalen-1-yloxyphenyl)ethanamine?
The InChIKey is FCVZAYCVACLXSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19NO/c1-14(20-2)16-9-5-10-17(13-16)21-19-12-6-8-15-7-3-4-11-18(15)19/h3-14,20H,1-2H3.
What are the key properties of N-methyl-1-(3-naphthalen-1-yloxyphenyl)ethanamine?
N-methyl-1-(3-naphthalen-1-yloxyphenyl)ethanamine has a molecular weight of 277.37 g/mol, XLogP of 4.91, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(3-naphthalen-1-yloxyphenyl)ethanamine is sourced from PubChem (CID 79166432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).