N-methyl-2-quinolin-7-yloxypropan-1-amine

C13H16N2O — CID 107313762

IUPACN-methyl-2-quinolin-7-yloxypropan-1-amine
SMILESCNCC(C)Oc1ccc2cccnc2c1
InChIInChI=1S/C13H16N2O/c1-10(9-14-2)16-12-6-5-11-4-3-7-15-13(11)8-12/h3-8,10,14H,9H2,1-2H3
InChIKeyBMGILPZDPVEMNK-UHFFFAOYSA-N
MW216.28 g/mol
LogP2.22
Rot. Bonds4

About N-methyl-2-quinolin-7-yloxypropan-1-amine

N-methyl-2-quinolin-7-yloxypropan-1-amine (PubChem CID 107313762) has the molecular formula C13H16N2O and a molecular weight of 216.28 g/mol. Its IUPAC name is N-methyl-2-quinolin-7-yloxypropan-1-amine.

Molecular Properties

Compound NameN-methyl-2-quinolin-7-yloxypropan-1-amine
PubChem CID107313762
Molecular FormulaC13H16N2O
Molecular Weight216.28 g/mol
Exact Mass216.13
IUPAC NameN-methyl-2-quinolin-7-yloxypropan-1-amine
SMILESCNCC(C)Oc1ccc2cccnc2c1
InChIInChI=1S/C13H16N2O/c1-10(9-14-2)16-12-6-5-11-4-3-7-15-13(11)8-12/h3-8,10,14H,9H2,1-2H3
InChIKeyBMGILPZDPVEMNK-UHFFFAOYSA-N
XLogP2.22
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-quinolin-7-yloxypropan-1-amine?
The IUPAC name of N-methyl-2-quinolin-7-yloxypropan-1-amine (CID 107313762) is N-methyl-2-quinolin-7-yloxypropan-1-amine.
What is the SMILES notation for N-methyl-2-quinolin-7-yloxypropan-1-amine?
The canonical SMILES for N-methyl-2-quinolin-7-yloxypropan-1-amine is CNCC(C)Oc1ccc2cccnc2c1.
What is the InChIKey of N-methyl-2-quinolin-7-yloxypropan-1-amine?
The InChIKey is BMGILPZDPVEMNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O/c1-10(9-14-2)16-12-6-5-11-4-3-7-15-13(11)8-12/h3-8,10,14H,9H2,1-2H3.
What are the key properties of N-methyl-2-quinolin-7-yloxypropan-1-amine?
N-methyl-2-quinolin-7-yloxypropan-1-amine has a molecular weight of 216.28 g/mol, XLogP of 2.22, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-quinolin-7-yloxypropan-1-amine is sourced from PubChem (CID 107313762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).