4-methoxy-8-methylnaphthalen-2-amine

C12H13NO — CID 105442632

IUPAC4-methoxy-8-methylnaphthalen-2-amine
SMILESCOc1cc(N)cc2c(C)cccc12
InChIInChI=1S/C12H13NO/c1-8-4-3-5-10-11(8)6-9(13)7-12(10)14-2/h3-7H,13H2,1-2H3
InChIKeyURMDHTBSJAHGCN-UHFFFAOYSA-N
MW187.24 g/mol
LogP2.74
Rot. Bonds1

About 4-methoxy-8-methylnaphthalen-2-amine

4-methoxy-8-methylnaphthalen-2-amine (PubChem CID 105442632) has the molecular formula C12H13NO and a molecular weight of 187.24 g/mol. Its IUPAC name is 4-methoxy-8-methylnaphthalen-2-amine.

Molecular Properties

Compound Name4-methoxy-8-methylnaphthalen-2-amine
PubChem CID105442632
Molecular FormulaC12H13NO
Molecular Weight187.24 g/mol
Exact Mass187.10
IUPAC Name4-methoxy-8-methylnaphthalen-2-amine
SMILESCOc1cc(N)cc2c(C)cccc12
InChIInChI=1S/C12H13NO/c1-8-4-3-5-10-11(8)6-9(13)7-12(10)14-2/h3-7H,13H2,1-2H3
InChIKeyURMDHTBSJAHGCN-UHFFFAOYSA-N
XLogP2.74
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.24
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

8-fluoro-4-methoxynaphthalen-2-amine
CID 105444772
4-methoxy-8-methylnaphthalene-2-sulfonic acid
CID 154521402
1,4-bis(2,6-dimethylphenyl)-2,5-dimethoxybenzene
CID 156631925
2-(2-methoxyphenoxy)-3-methylaniline
CID 115550846
ethane;methane;3-methoxy-4-methylaniline
CID 144516222
1-bromo-4-methoxynaphthalen-2-amine
CID 13160423
4-methoxy-1-methyl-2-(8-methylnaphthalen-2-yl)naphthalene
CID 130194968
1,5-dimethylnaphthalene
CID 162159355
6-methoxy-4-methylbenzo[h]quinoline
CID 11009579
(4-acetyloxy-3-methoxy-8-methylnaphthalen-1-yl) acetate
CID 19872716
6-amino-8-methoxynaphthalen-1-ol
CID 105443482
7-amino-5-methoxynaphthalen-2-ol
CID 105443487

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-8-methylnaphthalen-2-amine?
The IUPAC name of 4-methoxy-8-methylnaphthalen-2-amine (CID 105442632) is 4-methoxy-8-methylnaphthalen-2-amine.
What is the SMILES notation for 4-methoxy-8-methylnaphthalen-2-amine?
The canonical SMILES for 4-methoxy-8-methylnaphthalen-2-amine is COc1cc(N)cc2c(C)cccc12.
What is the InChIKey of 4-methoxy-8-methylnaphthalen-2-amine?
The InChIKey is URMDHTBSJAHGCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NO/c1-8-4-3-5-10-11(8)6-9(13)7-12(10)14-2/h3-7H,13H2,1-2H3.
What are the key properties of 4-methoxy-8-methylnaphthalen-2-amine?
4-methoxy-8-methylnaphthalen-2-amine has a molecular weight of 187.24 g/mol, XLogP of 2.74, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-8-methylnaphthalen-2-amine is sourced from PubChem (CID 105442632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).