N-methyl-1-(4-naphthalen-2-yloxyphenyl)ethanamine

C19H19NO — CID 43285636

IUPACN-methyl-1-(4-naphthalen-2-yloxyphenyl)ethanamine
SMILESCNC(C)c1ccc(Oc2ccc3ccccc3c2)cc1
InChIInChI=1S/C19H19NO/c1-14(20-2)15-7-10-18(11-8-15)21-19-12-9-16-5-3-4-6-17(16)13-19/h3-14,20H,1-2H3
InChIKeyCWRFZWCZNIWRGN-UHFFFAOYSA-N
MW277.37 g/mol
LogP4.91
Rot. Bonds4

About N-methyl-1-(4-naphthalen-2-yloxyphenyl)ethanamine

N-methyl-1-(4-naphthalen-2-yloxyphenyl)ethanamine (PubChem CID 43285636) has the molecular formula C19H19NO and a molecular weight of 277.37 g/mol. Its IUPAC name is N-methyl-1-(4-naphthalen-2-yloxyphenyl)ethanamine.

Molecular Properties

Compound NameN-methyl-1-(4-naphthalen-2-yloxyphenyl)ethanamine
PubChem CID43285636
Molecular FormulaC19H19NO
Molecular Weight277.37 g/mol
Exact Mass277.15
IUPAC NameN-methyl-1-(4-naphthalen-2-yloxyphenyl)ethanamine
SMILESCNC(C)c1ccc(Oc2ccc3ccccc3c2)cc1
InChIInChI=1S/C19H19NO/c1-14(20-2)15-7-10-18(11-8-15)21-19-12-9-16-5-3-4-6-17(16)13-19/h3-14,20H,1-2H3
InChIKeyCWRFZWCZNIWRGN-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-(4-naphthalen-2-yloxyphenyl)ethanamine?
The IUPAC name of N-methyl-1-(4-naphthalen-2-yloxyphenyl)ethanamine (CID 43285636) is N-methyl-1-(4-naphthalen-2-yloxyphenyl)ethanamine.
What is the SMILES notation for N-methyl-1-(4-naphthalen-2-yloxyphenyl)ethanamine?
The canonical SMILES for N-methyl-1-(4-naphthalen-2-yloxyphenyl)ethanamine is CNC(C)c1ccc(Oc2ccc3ccccc3c2)cc1.
What is the InChIKey of N-methyl-1-(4-naphthalen-2-yloxyphenyl)ethanamine?
The InChIKey is CWRFZWCZNIWRGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19NO/c1-14(20-2)15-7-10-18(11-8-15)21-19-12-9-16-5-3-4-6-17(16)13-19/h3-14,20H,1-2H3.
What are the key properties of N-methyl-1-(4-naphthalen-2-yloxyphenyl)ethanamine?
N-methyl-1-(4-naphthalen-2-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-(4-naphthalen-2-yloxyphenyl)ethanamine is sourced from PubChem (CID 43285636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).