N-[[2-(5,6,7,8-tetrahydroquinolin-8-yl)phenyl]methyl]cyclopropanamine

C19H22N2 — CID 79723595

IUPACN-[[2-(5,6,7,8-tetrahydroquinolin-8-yl)phenyl]methyl]cyclopropanamine
SMILESc1ccc(C2CCCc3cccnc32)c(CNC2CC2)c1
InChIInChI=1S/C19H22N2/c1-2-8-17(15(5-1)13-21-16-10-11-16)18-9-3-6-14-7-4-12-20-19(14)18/h1-2,4-5,7-8,12,16,18,21H,3,6,9-11,13H2
InChIKeyUQAYZMNUHCAOHI-UHFFFAOYSA-N
MW278.40 g/mol
LogP3.80
Rot. Bonds4

About N-[[2-(5,6,7,8-tetrahydroquinolin-8-yl)phenyl]methyl]cyclopropanamine

N-[[2-(5,6,7,8-tetrahydroquinolin-8-yl)phenyl]methyl]cyclopropanamine (PubChem CID 79723595) has the molecular formula C19H22N2 and a molecular weight of 278.40 g/mol. Its IUPAC name is N-[[2-(5,6,7,8-tetrahydroquinolin-8-yl)phenyl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[2-(5,6,7,8-tetrahydroquinolin-8-yl)phenyl]methyl]cyclopropanamine
PubChem CID79723595
Molecular FormulaC19H22N2
Molecular Weight278.40 g/mol
Exact Mass278.18
IUPAC NameN-[[2-(5,6,7,8-tetrahydroquinolin-8-yl)phenyl]methyl]cyclopropanamine
SMILESc1ccc(C2CCCc3cccnc32)c(CNC2CC2)c1
InChIInChI=1S/C19H22N2/c1-2-8-17(15(5-1)13-21-16-10-11-16)18-9-3-6-14-7-4-12-20-19(14)18/h1-2,4-5,7-8,12,16,18,21H,3,6,9-11,13H2
InChIKeyUQAYZMNUHCAOHI-UHFFFAOYSA-N
XLogP3.80
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[[2-(5,6,7,8-tetrahydroquinolin-8-yl)phenyl]methyl]cyclopropanamine?
The IUPAC name of N-[[2-(5,6,7,8-tetrahydroquinolin-8-yl)phenyl]methyl]cyclopropanamine (CID 79723595) is N-[[2-(5,6,7,8-tetrahydroquinolin-8-yl)phenyl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[2-(5,6,7,8-tetrahydroquinolin-8-yl)phenyl]methyl]cyclopropanamine?
The canonical SMILES for N-[[2-(5,6,7,8-tetrahydroquinolin-8-yl)phenyl]methyl]cyclopropanamine is c1ccc(C2CCCc3cccnc32)c(CNC2CC2)c1.
What is the InChIKey of N-[[2-(5,6,7,8-tetrahydroquinolin-8-yl)phenyl]methyl]cyclopropanamine?
The InChIKey is UQAYZMNUHCAOHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2/c1-2-8-17(15(5-1)13-21-16-10-11-16)18-9-3-6-14-7-4-12-20-19(14)18/h1-2,4-5,7-8,12,16,18,21H,3,6,9-11,13H2.
What are the key properties of N-[[2-(5,6,7,8-tetrahydroquinolin-8-yl)phenyl]methyl]cyclopropanamine?
N-[[2-(5,6,7,8-tetrahydroquinolin-8-yl)phenyl]methyl]cyclopropanamine has a molecular weight of 278.40 g/mol, XLogP of 3.80, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(5,6,7,8-tetrahydroquinolin-8-yl)phenyl]methyl]cyclopropanamine is sourced from PubChem (CID 79723595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).