N-methyl-1-naphthalen-2-ylmethanamine

C12H13N — CID 541935

IUPACN-methyl-1-naphthalen-2-ylmethanamine
SMILESCNCc1ccc2ccccc2c1
InChIInChI=1S/C12H13N/c1-13-9-10-6-7-11-4-2-3-5-12(11)8-10/h2-8,13H,9H2,1H3
InChIKeySSNISTUBYRMYDY-UHFFFAOYSA-N
MW171.24 g/mol
LogP2.56
Rot. Bonds2

About N-methyl-1-naphthalen-2-ylmethanamine

N-methyl-1-naphthalen-2-ylmethanamine (PubChem CID 541935) has the molecular formula C12H13N and a molecular weight of 171.24 g/mol. Its IUPAC name is N-methyl-1-naphthalen-2-ylmethanamine.

Molecular Properties

Compound NameN-methyl-1-naphthalen-2-ylmethanamine
PubChem CID541935
Molecular FormulaC12H13N
Molecular Weight171.24 g/mol
Exact Mass171.10
IUPAC NameN-methyl-1-naphthalen-2-ylmethanamine
SMILESCNCc1ccc2ccccc2c1
InChIInChI=1S/C12H13N/c1-13-9-10-6-7-11-4-2-3-5-12(11)8-10/h2-8,13H,9H2,1H3
InChIKeySSNISTUBYRMYDY-UHFFFAOYSA-N
XLogP2.56
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.24
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-naphthalen-2-ylmethanamine?
The IUPAC name of N-methyl-1-naphthalen-2-ylmethanamine (CID 541935) is N-methyl-1-naphthalen-2-ylmethanamine.
What is the SMILES notation for N-methyl-1-naphthalen-2-ylmethanamine?
The canonical SMILES for N-methyl-1-naphthalen-2-ylmethanamine is CNCc1ccc2ccccc2c1.
What is the InChIKey of N-methyl-1-naphthalen-2-ylmethanamine?
The InChIKey is SSNISTUBYRMYDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N/c1-13-9-10-6-7-11-4-2-3-5-12(11)8-10/h2-8,13H,9H2,1H3.
What are the key properties of N-methyl-1-naphthalen-2-ylmethanamine?
N-methyl-1-naphthalen-2-ylmethanamine has a molecular weight of 171.24 g/mol, XLogP of 2.56, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-naphthalen-2-ylmethanamine is sourced from PubChem (CID 541935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).