1-(8-methylnaphthalen-1-yl)ethanamine

C13H15N — CID 105441726

IUPAC1-(8-methylnaphthalen-1-yl)ethanamine
SMILESCc1cccc2cccc(C(C)N)c12
InChIInChI=1S/C13H15N/c1-9-5-3-6-11-7-4-8-12(10(2)14)13(9)11/h3-8,10H,14H2,1-2H3
InChIKeyFTGODBQHYXRISP-UHFFFAOYSA-N
MW185.27 g/mol
LogP3.17
Rot. Bonds1

About 1-(8-methylnaphthalen-1-yl)ethanamine

1-(8-methylnaphthalen-1-yl)ethanamine (PubChem CID 105441726) has the molecular formula C13H15N and a molecular weight of 185.27 g/mol. Its IUPAC name is 1-(8-methylnaphthalen-1-yl)ethanamine.

Molecular Properties

Compound Name1-(8-methylnaphthalen-1-yl)ethanamine
PubChem CID105441726
Molecular FormulaC13H15N
Molecular Weight185.27 g/mol
Exact Mass185.12
IUPAC Name1-(8-methylnaphthalen-1-yl)ethanamine
SMILESCc1cccc2cccc(C(C)N)c12
InChIInChI=1S/C13H15N/c1-9-5-3-6-11-7-4-8-12(10(2)14)13(9)11/h3-8,10H,14H2,1-2H3
InChIKeyFTGODBQHYXRISP-UHFFFAOYSA-N
XLogP3.17
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(4-methylisoquinolin-5-yl)ethanamine
CID 82575690
1-(8-methylnaphthalen-1-yl)ethanol
CID 15563489
bis((1S)-1-(2-methylphenyl)ethanamine);dihydrochloride
CID 134129357
(1R)-1-(2-bromo-3-methylphenyl)ethanamine
CID 96955711
1,8-dimethylnaphthalene;ethane
CID 91447117
1-(4-methyl-1-benzothiophen-3-yl)ethanamine
CID 117119248
2-[1-(8-methylnaphthalen-1-yl)ethyl]benzamide
CID 134871055
1-(4-methyl-1H-indol-3-yl)ethanamine
CID 82598720
1,8-dimethyl-2-propan-2-ylnaphthalene
CID 174870278
4,5-dimethylphenanthrene;ethane
CID 143983787
4,21-dimethylpentacyclo[12.8.0.02,11.03,8.017,22]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaene
CID 177492723
carbamoyl 2-amino-3-(8-methylnaphthalen-1-yl)butanimidate
CID 138535838

Frequently Asked Questions

What is the IUPAC name of 1-(8-methylnaphthalen-1-yl)ethanamine?
The IUPAC name of 1-(8-methylnaphthalen-1-yl)ethanamine (CID 105441726) is 1-(8-methylnaphthalen-1-yl)ethanamine.
What is the SMILES notation for 1-(8-methylnaphthalen-1-yl)ethanamine?
The canonical SMILES for 1-(8-methylnaphthalen-1-yl)ethanamine is Cc1cccc2cccc(C(C)N)c12.
What is the InChIKey of 1-(8-methylnaphthalen-1-yl)ethanamine?
The InChIKey is FTGODBQHYXRISP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N/c1-9-5-3-6-11-7-4-8-12(10(2)14)13(9)11/h3-8,10H,14H2,1-2H3.
What are the key properties of 1-(8-methylnaphthalen-1-yl)ethanamine?
1-(8-methylnaphthalen-1-yl)ethanamine has a molecular weight of 185.27 g/mol, XLogP of 3.17, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(8-methylnaphthalen-1-yl)ethanamine is sourced from PubChem (CID 105441726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).