N-methylnaphthalen-1-amine

C11H11N — CID 16667

IUPACN-methylnaphthalen-1-amine
SMILESCNc1cccc2ccccc12
InChIInChI=1S/C11H11N/c1-12-11-8-4-6-9-5-2-3-7-10(9)11/h2-8,12H,1H3
InChIKeyAKEYUWUEAXIBTF-UHFFFAOYSA-N
MW157.22 g/mol
LogP2.88
Rot. Bonds1

About N-methylnaphthalen-1-amine

N-methylnaphthalen-1-amine (PubChem CID 16667) has the molecular formula C11H11N and a molecular weight of 157.22 g/mol. Its IUPAC name is N-methylnaphthalen-1-amine.

Molecular Properties

Compound NameN-methylnaphthalen-1-amine
PubChem CID16667
Molecular FormulaC11H11N
Molecular Weight157.22 g/mol
Exact Mass157.09
IUPAC NameN-methylnaphthalen-1-amine
SMILESCNc1cccc2ccccc12
InChIInChI=1S/C11H11N/c1-12-11-8-4-6-9-5-2-3-7-10(9)11/h2-8,12H,1H3
InChIKeyAKEYUWUEAXIBTF-UHFFFAOYSA-N
XLogP2.88
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.22
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-methylnaphthalen-1-amine?
The IUPAC name of N-methylnaphthalen-1-amine (CID 16667) is N-methylnaphthalen-1-amine.
What is the SMILES notation for N-methylnaphthalen-1-amine?
The canonical SMILES for N-methylnaphthalen-1-amine is CNc1cccc2ccccc12.
What is the InChIKey of N-methylnaphthalen-1-amine?
The InChIKey is AKEYUWUEAXIBTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N/c1-12-11-8-4-6-9-5-2-3-7-10(9)11/h2-8,12H,1H3.
What are the key properties of N-methylnaphthalen-1-amine?
N-methylnaphthalen-1-amine has a molecular weight of 157.22 g/mol, XLogP of 2.88, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methylnaphthalen-1-amine is sourced from PubChem (CID 16667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).