(2,8-dimethyl-6,7-dihydroquinolin-3-yl)methanamine

C12H16N2 — CID 135292628

IUPAC(2,8-dimethyl-6,7-dihydroquinolin-3-yl)methanamine
SMILESCC1=c2nc(C)c(CN)cc2=CCC1
InChIInChI=1S/C12H16N2/c1-8-4-3-5-10-6-11(7-13)9(2)14-12(8)10/h5-6H,3-4,7,13H2,1-2H3
InChIKeyQRNADDZLYZICEM-UHFFFAOYSA-N
MW188.27 g/mol
LogP0.59
Rot. Bonds1

About (2,8-dimethyl-6,7-dihydroquinolin-3-yl)methanamine

(2,8-dimethyl-6,7-dihydroquinolin-3-yl)methanamine (PubChem CID 135292628) has the molecular formula C12H16N2 and a molecular weight of 188.27 g/mol. Its IUPAC name is (2,8-dimethyl-6,7-dihydroquinolin-3-yl)methanamine.

Molecular Properties

Compound Name(2,8-dimethyl-6,7-dihydroquinolin-3-yl)methanamine
PubChem CID135292628
Molecular FormulaC12H16N2
Molecular Weight188.27 g/mol
Exact Mass188.13
IUPAC Name(2,8-dimethyl-6,7-dihydroquinolin-3-yl)methanamine
SMILESCC1=c2nc(C)c(CN)cc2=CCC1
InChIInChI=1S/C12H16N2/c1-8-4-3-5-10-6-11(7-13)9(2)14-12(8)10/h5-6H,3-4,7,13H2,1-2H3
InChIKeyQRNADDZLYZICEM-UHFFFAOYSA-N
XLogP0.59
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 50.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2,8-dimethyl-6,7-dihydroquinolin-3-yl)methanamine?
The IUPAC name of (2,8-dimethyl-6,7-dihydroquinolin-3-yl)methanamine (CID 135292628) is (2,8-dimethyl-6,7-dihydroquinolin-3-yl)methanamine.
What is the SMILES notation for (2,8-dimethyl-6,7-dihydroquinolin-3-yl)methanamine?
The canonical SMILES for (2,8-dimethyl-6,7-dihydroquinolin-3-yl)methanamine is CC1=c2nc(C)c(CN)cc2=CCC1.
What is the InChIKey of (2,8-dimethyl-6,7-dihydroquinolin-3-yl)methanamine?
The InChIKey is QRNADDZLYZICEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2/c1-8-4-3-5-10-6-11(7-13)9(2)14-12(8)10/h5-6H,3-4,7,13H2,1-2H3.
What are the key properties of (2,8-dimethyl-6,7-dihydroquinolin-3-yl)methanamine?
(2,8-dimethyl-6,7-dihydroquinolin-3-yl)methanamine has a molecular weight of 188.27 g/mol, XLogP of 0.59, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2,8-dimethyl-6,7-dihydroquinolin-3-yl)methanamine is sourced from PubChem (CID 135292628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).