N-methyl-4,4a-dihydroquinolin-6-amine

C10H12N2 — CID 142276743

IUPACN-methyl-4,4a-dihydroquinolin-6-amine
SMILESCNC1=CC2CC=CN=C2C=C1
InChIInChI=1S/C10H12N2/c1-11-9-4-5-10-8(7-9)3-2-6-12-10/h2,4-8,11H,3H2,1H3
InChIKeyXQMXYWSTSSHDQX-UHFFFAOYSA-N
MW160.22 g/mol
LogP1.63
Rot. Bonds1

About N-methyl-4,4a-dihydroquinolin-6-amine

N-methyl-4,4a-dihydroquinolin-6-amine (PubChem CID 142276743) has the molecular formula C10H12N2 and a molecular weight of 160.22 g/mol. Its IUPAC name is N-methyl-4,4a-dihydroquinolin-6-amine.

Molecular Properties

Compound NameN-methyl-4,4a-dihydroquinolin-6-amine
PubChem CID142276743
Molecular FormulaC10H12N2
Molecular Weight160.22 g/mol
Exact Mass160.10
IUPAC NameN-methyl-4,4a-dihydroquinolin-6-amine
SMILESCNC1=CC2CC=CN=C2C=C1
InChIInChI=1S/C10H12N2/c1-11-9-4-5-10-8(7-9)3-2-6-12-10/h2,4-8,11H,3H2,1H3
InChIKeyXQMXYWSTSSHDQX-UHFFFAOYSA-N
XLogP1.63
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.22
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-4,4a-dihydroquinolin-6-amine?
The IUPAC name of N-methyl-4,4a-dihydroquinolin-6-amine (CID 142276743) is N-methyl-4,4a-dihydroquinolin-6-amine.
What is the SMILES notation for N-methyl-4,4a-dihydroquinolin-6-amine?
The canonical SMILES for N-methyl-4,4a-dihydroquinolin-6-amine is CNC1=CC2CC=CN=C2C=C1.
What is the InChIKey of N-methyl-4,4a-dihydroquinolin-6-amine?
The InChIKey is XQMXYWSTSSHDQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2/c1-11-9-4-5-10-8(7-9)3-2-6-12-10/h2,4-8,11H,3H2,1H3.
What are the key properties of N-methyl-4,4a-dihydroquinolin-6-amine?
N-methyl-4,4a-dihydroquinolin-6-amine has a molecular weight of 160.22 g/mol, XLogP of 1.63, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4,4a-dihydroquinolin-6-amine is sourced from PubChem (CID 142276743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).