2-methyl-N-(2-methyl-2-piperidin-1-ylpropyl)quinolin-4-amine

C19H27N3 — CID 71899453

IUPAC2-methyl-N-(2-methyl-2-piperidin-1-ylpropyl)quinolin-4-amine
SMILESCc1cc(NCC(C)(C)N2CCCCC2)c2ccccc2n1
InChIInChI=1S/C19H27N3/c1-15-13-18(16-9-5-6-10-17(16)21-15)20-14-19(2,3)22-11-7-4-8-12-22/h5-6,9-10,13H,4,7-8,11-12,14H2,1-3H3,(H,20,21)
InChIKeyHFNLPBAVYHJPBL-UHFFFAOYSA-N
MW297.45 g/mol
LogP4.22
Rot. Bonds4

About 2-methyl-N-(2-methyl-2-piperidin-1-ylpropyl)quinolin-4-amine

2-methyl-N-(2-methyl-2-piperidin-1-ylpropyl)quinolin-4-amine (PubChem CID 71899453) has the molecular formula C19H27N3 and a molecular weight of 297.45 g/mol. Its IUPAC name is 2-methyl-N-(2-methyl-2-piperidin-1-ylpropyl)quinolin-4-amine.

Molecular Properties

Compound Name2-methyl-N-(2-methyl-2-piperidin-1-ylpropyl)quinolin-4-amine
PubChem CID71899453
Molecular FormulaC19H27N3
Molecular Weight297.45 g/mol
Exact Mass297.22
IUPAC Name2-methyl-N-(2-methyl-2-piperidin-1-ylpropyl)quinolin-4-amine
SMILESCc1cc(NCC(C)(C)N2CCCCC2)c2ccccc2n1
InChIInChI=1S/C19H27N3/c1-15-13-18(16-9-5-6-10-17(16)21-15)20-14-19(2,3)22-11-7-4-8-12-22/h5-6,9-10,13H,4,7-8,11-12,14H2,1-3H3,(H,20,21)
InChIKeyHFNLPBAVYHJPBL-UHFFFAOYSA-N
XLogP4.22
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.45
LogP ≤ 54.22
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-methyl-2-piperidin-1-ylpropyl)quinolin-4-amine?
The IUPAC name of 2-methyl-N-(2-methyl-2-piperidin-1-ylpropyl)quinolin-4-amine (CID 71899453) is 2-methyl-N-(2-methyl-2-piperidin-1-ylpropyl)quinolin-4-amine.
What is the SMILES notation for 2-methyl-N-(2-methyl-2-piperidin-1-ylpropyl)quinolin-4-amine?
The canonical SMILES for 2-methyl-N-(2-methyl-2-piperidin-1-ylpropyl)quinolin-4-amine is Cc1cc(NCC(C)(C)N2CCCCC2)c2ccccc2n1.
What is the InChIKey of 2-methyl-N-(2-methyl-2-piperidin-1-ylpropyl)quinolin-4-amine?
The InChIKey is HFNLPBAVYHJPBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N3/c1-15-13-18(16-9-5-6-10-17(16)21-15)20-14-19(2,3)22-11-7-4-8-12-22/h5-6,9-10,13H,4,7-8,11-12,14H2,1-3H3,(H,20,21).
What are the key properties of 2-methyl-N-(2-methyl-2-piperidin-1-ylpropyl)quinolin-4-amine?
2-methyl-N-(2-methyl-2-piperidin-1-ylpropyl)quinolin-4-amine has a molecular weight of 297.45 g/mol, XLogP of 4.22, 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-methyl-2-piperidin-1-ylpropyl)quinolin-4-amine is sourced from PubChem (CID 71899453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).