8-methyl-N-(1-methylazepan-4-yl)quinolin-5-amine

C17H23N3 — CID 65070427

IUPAC8-methyl-N-(1-methylazepan-4-yl)quinolin-5-amine
SMILESCc1ccc(NC2CCCN(C)CC2)c2cccnc12
InChIInChI=1S/C17H23N3/c1-13-7-8-16(15-6-3-10-18-17(13)15)19-14-5-4-11-20(2)12-9-14/h3,6-8,10,14,19H,4-5,9,11-12H2,1-2H3
InChIKeyGCDUJPYDGYFYJH-UHFFFAOYSA-N
MW269.39 g/mol
LogP3.44
Rot. Bonds2

About 8-methyl-N-(1-methylazepan-4-yl)quinolin-5-amine

8-methyl-N-(1-methylazepan-4-yl)quinolin-5-amine (PubChem CID 65070427) has the molecular formula C17H23N3 and a molecular weight of 269.39 g/mol. Its IUPAC name is 8-methyl-N-(1-methylazepan-4-yl)quinolin-5-amine.

Molecular Properties

Compound Name8-methyl-N-(1-methylazepan-4-yl)quinolin-5-amine
PubChem CID65070427
Molecular FormulaC17H23N3
Molecular Weight269.39 g/mol
Exact Mass269.19
IUPAC Name8-methyl-N-(1-methylazepan-4-yl)quinolin-5-amine
SMILESCc1ccc(NC2CCCN(C)CC2)c2cccnc12
InChIInChI=1S/C17H23N3/c1-13-7-8-16(15-6-3-10-18-17(13)15)19-14-5-4-11-20(2)12-9-14/h3,6-8,10,14,19H,4-5,9,11-12H2,1-2H3
InChIKeyGCDUJPYDGYFYJH-UHFFFAOYSA-N
XLogP3.44
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-methyl-N-(1-methylazepan-4-yl)quinolin-5-amine?
The IUPAC name of 8-methyl-N-(1-methylazepan-4-yl)quinolin-5-amine (CID 65070427) is 8-methyl-N-(1-methylazepan-4-yl)quinolin-5-amine.
What is the SMILES notation for 8-methyl-N-(1-methylazepan-4-yl)quinolin-5-amine?
The canonical SMILES for 8-methyl-N-(1-methylazepan-4-yl)quinolin-5-amine is Cc1ccc(NC2CCCN(C)CC2)c2cccnc12.
What is the InChIKey of 8-methyl-N-(1-methylazepan-4-yl)quinolin-5-amine?
The InChIKey is GCDUJPYDGYFYJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3/c1-13-7-8-16(15-6-3-10-18-17(13)15)19-14-5-4-11-20(2)12-9-14/h3,6-8,10,14,19H,4-5,9,11-12H2,1-2H3.
What are the key properties of 8-methyl-N-(1-methylazepan-4-yl)quinolin-5-amine?
8-methyl-N-(1-methylazepan-4-yl)quinolin-5-amine has a molecular weight of 269.39 g/mol, XLogP of 3.44, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-N-(1-methylazepan-4-yl)quinolin-5-amine is sourced from PubChem (CID 65070427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).