2-methyl-N-(2-quinolin-7-yloxypropyl)propan-2-amine

C16H22N2O — CID 107314978

IUPAC2-methyl-N-(2-quinolin-7-yloxypropyl)propan-2-amine
SMILESCC(CNC(C)(C)C)Oc1ccc2cccnc2c1
InChIInChI=1S/C16H22N2O/c1-12(11-18-16(2,3)4)19-14-8-7-13-6-5-9-17-15(13)10-14/h5-10,12,18H,11H2,1-4H3
InChIKeyWBMNJQHNUNIDBI-UHFFFAOYSA-N
MW258.36 g/mol
LogP3.39
Rot. Bonds4

About 2-methyl-N-(2-quinolin-7-yloxypropyl)propan-2-amine

2-methyl-N-(2-quinolin-7-yloxypropyl)propan-2-amine (PubChem CID 107314978) has the molecular formula C16H22N2O and a molecular weight of 258.36 g/mol. Its IUPAC name is 2-methyl-N-(2-quinolin-7-yloxypropyl)propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-(2-quinolin-7-yloxypropyl)propan-2-amine
PubChem CID107314978
Molecular FormulaC16H22N2O
Molecular Weight258.36 g/mol
Exact Mass258.17
IUPAC Name2-methyl-N-(2-quinolin-7-yloxypropyl)propan-2-amine
SMILESCC(CNC(C)(C)C)Oc1ccc2cccnc2c1
InChIInChI=1S/C16H22N2O/c1-12(11-18-16(2,3)4)19-14-8-7-13-6-5-9-17-15(13)10-14/h5-10,12,18H,11H2,1-4H3
InChIKeyWBMNJQHNUNIDBI-UHFFFAOYSA-N
XLogP3.39
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(2-quinolin-7-yloxypropyl)propan-2-amine?
The IUPAC name of 2-methyl-N-(2-quinolin-7-yloxypropyl)propan-2-amine (CID 107314978) is 2-methyl-N-(2-quinolin-7-yloxypropyl)propan-2-amine.
What is the SMILES notation for 2-methyl-N-(2-quinolin-7-yloxypropyl)propan-2-amine?
The canonical SMILES for 2-methyl-N-(2-quinolin-7-yloxypropyl)propan-2-amine is CC(CNC(C)(C)C)Oc1ccc2cccnc2c1.
What is the InChIKey of 2-methyl-N-(2-quinolin-7-yloxypropyl)propan-2-amine?
The InChIKey is WBMNJQHNUNIDBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O/c1-12(11-18-16(2,3)4)19-14-8-7-13-6-5-9-17-15(13)10-14/h5-10,12,18H,11H2,1-4H3.
What are the key properties of 2-methyl-N-(2-quinolin-7-yloxypropyl)propan-2-amine?
2-methyl-N-(2-quinolin-7-yloxypropyl)propan-2-amine has a molecular weight of 258.36 g/mol, XLogP of 3.39, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(2-quinolin-7-yloxypropyl)propan-2-amine is sourced from PubChem (CID 107314978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).