(1-propyl-3,4-dihydro-2H-quinolin-6-yl)methanamine

C13H20N2 — CID 651423

IUPAC(1-propyl-3,4-dihydro-2H-quinolin-6-yl)methanamine
SMILESCCCN1CCCc2cc(CN)ccc21
InChIInChI=1S/C13H20N2/c1-2-7-15-8-3-4-12-9-11(10-14)5-6-13(12)15/h5-6,9H,2-4,7-8,10,14H2,1H3
InChIKeyHMHYSHNUJGNYIX-UHFFFAOYSA-N
MW204.32 g/mol
LogP2.31
Rot. Bonds3

About (1-propyl-3,4-dihydro-2H-quinolin-6-yl)methanamine

(1-propyl-3,4-dihydro-2H-quinolin-6-yl)methanamine (PubChem CID 651423) has the molecular formula C13H20N2 and a molecular weight of 204.32 g/mol. Its IUPAC name is (1-propyl-3,4-dihydro-2H-quinolin-6-yl)methanamine.

Molecular Properties

Compound Name(1-propyl-3,4-dihydro-2H-quinolin-6-yl)methanamine
PubChem CID651423
Molecular FormulaC13H20N2
Molecular Weight204.32 g/mol
Exact Mass204.16
IUPAC Name(1-propyl-3,4-dihydro-2H-quinolin-6-yl)methanamine
SMILESCCCN1CCCc2cc(CN)ccc21
InChIInChI=1S/C13H20N2/c1-2-7-15-8-3-4-12-9-11(10-14)5-6-13(12)15/h5-6,9H,2-4,7-8,10,14H2,1H3
InChIKeyHMHYSHNUJGNYIX-UHFFFAOYSA-N
XLogP2.31
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.32
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1-propyl-3,4-dihydro-2H-quinolin-6-yl)methanamine?
The IUPAC name of (1-propyl-3,4-dihydro-2H-quinolin-6-yl)methanamine (CID 651423) is (1-propyl-3,4-dihydro-2H-quinolin-6-yl)methanamine.
What is the SMILES notation for (1-propyl-3,4-dihydro-2H-quinolin-6-yl)methanamine?
The canonical SMILES for (1-propyl-3,4-dihydro-2H-quinolin-6-yl)methanamine is CCCN1CCCc2cc(CN)ccc21.
What is the InChIKey of (1-propyl-3,4-dihydro-2H-quinolin-6-yl)methanamine?
The InChIKey is HMHYSHNUJGNYIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2/c1-2-7-15-8-3-4-12-9-11(10-14)5-6-13(12)15/h5-6,9H,2-4,7-8,10,14H2,1H3.
What are the key properties of (1-propyl-3,4-dihydro-2H-quinolin-6-yl)methanamine?
(1-propyl-3,4-dihydro-2H-quinolin-6-yl)methanamine has a molecular weight of 204.32 g/mol, XLogP of 2.31, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-propyl-3,4-dihydro-2H-quinolin-6-yl)methanamine is sourced from PubChem (CID 651423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).