5-methyl-1,2,3,4-tetrahydroquinolin-8-amine

C10H14N2 — CID 84651445

IUPAC5-methyl-1,2,3,4-tetrahydroquinolin-8-amine
SMILESCc1ccc(N)c2c1CCCN2
InChIInChI=1S/C10H14N2/c1-7-4-5-9(11)10-8(7)3-2-6-12-10/h4-5,12H,2-3,6,11H2,1H3
InChIKeyHDQWDNSOBJUVOA-UHFFFAOYSA-N
MW162.24 g/mol
LogP1.94
Rot. Bonds

About 5-methyl-1,2,3,4-tetrahydroquinolin-8-amine

5-methyl-1,2,3,4-tetrahydroquinolin-8-amine (PubChem CID 84651445) has the molecular formula C10H14N2 and a molecular weight of 162.24 g/mol. Its IUPAC name is 5-methyl-1,2,3,4-tetrahydroquinolin-8-amine.

Molecular Properties

Compound Name5-methyl-1,2,3,4-tetrahydroquinolin-8-amine
PubChem CID84651445
Molecular FormulaC10H14N2
Molecular Weight162.24 g/mol
Exact Mass162.12
IUPAC Name5-methyl-1,2,3,4-tetrahydroquinolin-8-amine
SMILESCc1ccc(N)c2c1CCCN2
InChIInChI=1S/C10H14N2/c1-7-4-5-9(11)10-8(7)3-2-6-12-10/h4-5,12H,2-3,6,11H2,1H3
InChIKeyHDQWDNSOBJUVOA-UHFFFAOYSA-N
XLogP1.94
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.24
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-1,2,3,4-tetrahydroquinolin-8-amine?
The IUPAC name of 5-methyl-1,2,3,4-tetrahydroquinolin-8-amine (CID 84651445) is 5-methyl-1,2,3,4-tetrahydroquinolin-8-amine.
What is the SMILES notation for 5-methyl-1,2,3,4-tetrahydroquinolin-8-amine?
The canonical SMILES for 5-methyl-1,2,3,4-tetrahydroquinolin-8-amine is Cc1ccc(N)c2c1CCCN2.
What is the InChIKey of 5-methyl-1,2,3,4-tetrahydroquinolin-8-amine?
The InChIKey is HDQWDNSOBJUVOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2/c1-7-4-5-9(11)10-8(7)3-2-6-12-10/h4-5,12H,2-3,6,11H2,1H3.
What are the key properties of 5-methyl-1,2,3,4-tetrahydroquinolin-8-amine?
5-methyl-1,2,3,4-tetrahydroquinolin-8-amine has a molecular weight of 162.24 g/mol, XLogP of 1.94, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-1,2,3,4-tetrahydroquinolin-8-amine is sourced from PubChem (CID 84651445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).