1-(3-methylphenyl)naphthalen-2-amine

C17H15N — CID 141043466

IUPAC1-(3-methylphenyl)naphthalen-2-amine
SMILESCc1cccc(-c2c(N)ccc3ccccc23)c1
InChIInChI=1S/C17H15N/c1-12-5-4-7-14(11-12)17-15-8-3-2-6-13(15)9-10-16(17)18/h2-11H,18H2,1H3
InChIKeyDYKBXEWEMVVBEQ-UHFFFAOYSA-N
MW233.31 g/mol
LogP4.40
Rot. Bonds1

About 1-(3-methylphenyl)naphthalen-2-amine

1-(3-methylphenyl)naphthalen-2-amine (PubChem CID 141043466) has the molecular formula C17H15N and a molecular weight of 233.31 g/mol. Its IUPAC name is 1-(3-methylphenyl)naphthalen-2-amine.

Molecular Properties

Compound Name1-(3-methylphenyl)naphthalen-2-amine
PubChem CID141043466
Molecular FormulaC17H15N
Molecular Weight233.31 g/mol
Exact Mass233.12
IUPAC Name1-(3-methylphenyl)naphthalen-2-amine
SMILESCc1cccc(-c2c(N)ccc3ccccc23)c1
InChIInChI=1S/C17H15N/c1-12-5-4-7-14(11-12)17-15-8-3-2-6-13(15)9-10-16(17)18/h2-11H,18H2,1H3
InChIKeyDYKBXEWEMVVBEQ-UHFFFAOYSA-N
XLogP4.40
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 54.40
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

1-(2-aminonaphthalen-1-yl)-7-methylnaphthalen-2-amine
CID 11266515
2-[1-(3-methylphenyl)naphthalen-2-yl]triphenylene
CID 145415013
1-(2-methylnaphthalen-1-yl)naphthalen-2-amine
CID 18736750
1-(2-aminonaphthalen-1-yl)naphthalen-2-amine;hydrochloride
CID 139641730
1-(2-amino-7-methylnaphthalen-1-yl)naphthalen-2-ol
CID 162122233
9-(3-methylphenyl)-10-[8-(2-phenylphenyl)naphthalen-2-yl]anthracene
CID 144837207
9-(3-methylphenyl)-10-[6-(3-phenylphenyl)naphthalen-2-yl]anthracene
CID 163825229
5-methyl-2-(2-methylnaphthalen-1-yl)aniline
CID 82767076
2-ethyl-4-(2-methylnaphthalen-1-yl)aniline
CID 81432895
2-[1-(3-methylphenyl)naphthalen-2-yl]-9,9'-spirobi[fluorene]
CID 145414946
ethane;9-[4-(3-methylphenyl)naphthalen-1-yl]-10-naphthalen-2-ylanthracene
CID 157325912
9-(3-methylphenyl)-2,7-diphenylanthracene
CID 142700269

Frequently Asked Questions

What is the IUPAC name of 1-(3-methylphenyl)naphthalen-2-amine?
The IUPAC name of 1-(3-methylphenyl)naphthalen-2-amine (CID 141043466) is 1-(3-methylphenyl)naphthalen-2-amine.
What is the SMILES notation for 1-(3-methylphenyl)naphthalen-2-amine?
The canonical SMILES for 1-(3-methylphenyl)naphthalen-2-amine is Cc1cccc(-c2c(N)ccc3ccccc23)c1.
What is the InChIKey of 1-(3-methylphenyl)naphthalen-2-amine?
The InChIKey is DYKBXEWEMVVBEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N/c1-12-5-4-7-14(11-12)17-15-8-3-2-6-13(15)9-10-16(17)18/h2-11H,18H2,1H3.
What are the key properties of 1-(3-methylphenyl)naphthalen-2-amine?
1-(3-methylphenyl)naphthalen-2-amine has a molecular weight of 233.31 g/mol, XLogP of 4.40, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methylphenyl)naphthalen-2-amine is sourced from PubChem (CID 141043466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).