1-benzyl-N-methylnaphthalen-2-amine

C18H17N — CID 174703862

IUPAC1-benzyl-N-methylnaphthalen-2-amine
SMILESCNc1ccc2ccccc2c1Cc1ccccc1
InChIInChI=1S/C18H17N/c1-19-18-12-11-15-9-5-6-10-16(15)17(18)13-14-7-3-2-4-8-14/h2-12,19H,13H2,1H3
InChIKeyWHWQSYZYVUETIO-UHFFFAOYSA-N
MW247.34 g/mol
LogP4.47
Rot. Bonds3

About 1-benzyl-N-methylnaphthalen-2-amine

1-benzyl-N-methylnaphthalen-2-amine (PubChem CID 174703862) has the molecular formula C18H17N and a molecular weight of 247.34 g/mol. Its IUPAC name is 1-benzyl-N-methylnaphthalen-2-amine.

Molecular Properties

Compound Name1-benzyl-N-methylnaphthalen-2-amine
PubChem CID174703862
Molecular FormulaC18H17N
Molecular Weight247.34 g/mol
Exact Mass247.14
IUPAC Name1-benzyl-N-methylnaphthalen-2-amine
SMILESCNc1ccc2ccccc2c1Cc1ccccc1
InChIInChI=1S/C18H17N/c1-19-18-12-11-15-9-5-6-10-16(15)17(18)13-14-7-3-2-4-8-14/h2-12,19H,13H2,1H3
InChIKeyWHWQSYZYVUETIO-UHFFFAOYSA-N
XLogP4.47
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 54.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1-benzylnaphthalen-2-yl)hydrazine
CID 118552617
N-(1-benzylnaphthalen-2-yl)methanesulfonamide
CID 176881930
1-decyl-N-methylnaphthalen-2-amine
CID 174691117
1-benzyl-2-ethoxynaphthalene
CID 12064074
1-benzylnaphthalene;N-methylmethanamine
CID 70612820
1-benzylnaphthalene-2-sulfonic acid
CID 20531531
1-benzyl-2-prop-2-enylnaphthalene
CID 173093978
2-(methylamino)naphthalene-1-carbonitrile
CID 12758537
benzylbenzene;ethane;bis(N-phenylnaphthalen-1-amine)
CID 157375605
N-methyl-1-[(E)-2-methyl-1,5-diphenylpent-4-en-2-yl]naphthalen-2-amine
CID 143655801
2-benzyl-1-methoxynaphthalene
CID 15617899
benzylbenzene;ethane;methanamine
CID 54117827

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-N-methylnaphthalen-2-amine?
The IUPAC name of 1-benzyl-N-methylnaphthalen-2-amine (CID 174703862) is 1-benzyl-N-methylnaphthalen-2-amine.
What is the SMILES notation for 1-benzyl-N-methylnaphthalen-2-amine?
The canonical SMILES for 1-benzyl-N-methylnaphthalen-2-amine is CNc1ccc2ccccc2c1Cc1ccccc1.
What is the InChIKey of 1-benzyl-N-methylnaphthalen-2-amine?
The InChIKey is WHWQSYZYVUETIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N/c1-19-18-12-11-15-9-5-6-10-16(15)17(18)13-14-7-3-2-4-8-14/h2-12,19H,13H2,1H3.
What are the key properties of 1-benzyl-N-methylnaphthalen-2-amine?
1-benzyl-N-methylnaphthalen-2-amine has a molecular weight of 247.34 g/mol, XLogP of 4.47, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-N-methylnaphthalen-2-amine is sourced from PubChem (CID 174703862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).