naphthalen-2-amine

C10H9N — CID 7057

IUPACnaphthalen-2-amine
SMILESNc1ccc2ccccc2c1
InChIInChI=1S/C10H9N/c11-10-6-5-8-3-1-2-4-9(8)7-10/h1-7H,11H2
InChIKeyJBIJLHTVPXGSAM-UHFFFAOYSA-N
MW143.19 g/mol
LogP2.42
Rot. Bonds

About naphthalen-2-amine

naphthalen-2-amine (PubChem CID 7057) has the molecular formula C10H9N and a molecular weight of 143.19 g/mol. Its IUPAC name is naphthalen-2-amine.

Molecular Properties

Compound Namenaphthalen-2-amine
PubChem CID7057
Molecular FormulaC10H9N
Molecular Weight143.19 g/mol
Exact Mass143.07
IUPAC Namenaphthalen-2-amine
SMILESNc1ccc2ccccc2c1
InChIInChI=1S/C10H9N/c11-10-6-5-8-3-1-2-4-9(8)7-10/h1-7H,11H2
InChIKeyJBIJLHTVPXGSAM-UHFFFAOYSA-N
XLogP2.42
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.19
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

4,4-Diaminodiphenylmethane
CID 7577
Benzidine
CID 7111
N-phenyl-2-naphthylamine
CID 8679
1-Naphthylamine
CID 8640
4-Aminobiphenyl
CID 7102
2-Aminofluorene
CID 1539
2-Aminoanthracene
CID 11937
2-Aminobiphenyl
CID 7015
1,5-Diaminonaphthalene
CID 16720
3,4-Dimethylaniline
CID 7248
1-Naphthyl Isothiocyanate
CID 11080
1-Aminopyrene
CID 15352

Frequently Asked Questions

What is the IUPAC name of naphthalen-2-amine?
The IUPAC name of naphthalen-2-amine (CID 7057) is naphthalen-2-amine.
What is the SMILES notation for naphthalen-2-amine?
The canonical SMILES for naphthalen-2-amine is Nc1ccc2ccccc2c1.
What is the InChIKey of naphthalen-2-amine?
The InChIKey is JBIJLHTVPXGSAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N/c11-10-6-5-8-3-1-2-4-9(8)7-10/h1-7H,11H2.
What are the key properties of naphthalen-2-amine?
naphthalen-2-amine has a molecular weight of 143.19 g/mol, XLogP of 2.42, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for naphthalen-2-amine is sourced from PubChem (CID 7057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).