N-(1-ethylazepan-4-yl)quinolin-8-amine

C17H23N3 — CID 65073031

IUPACN-(1-ethylazepan-4-yl)quinolin-8-amine
SMILESCCN1CCCC(Nc2cccc3cccnc23)CC1
InChIInChI=1S/C17H23N3/c1-2-20-12-5-8-15(10-13-20)19-16-9-3-6-14-7-4-11-18-17(14)16/h3-4,6-7,9,11,15,19H,2,5,8,10,12-13H2,1H3
InChIKeyOKZDQSRJSRUVHQ-UHFFFAOYSA-N
MW269.39 g/mol
LogP3.52
Rot. Bonds3

About N-(1-ethylazepan-4-yl)quinolin-8-amine

N-(1-ethylazepan-4-yl)quinolin-8-amine (PubChem CID 65073031) has the molecular formula C17H23N3 and a molecular weight of 269.39 g/mol. Its IUPAC name is N-(1-ethylazepan-4-yl)quinolin-8-amine.

Molecular Properties

Compound NameN-(1-ethylazepan-4-yl)quinolin-8-amine
PubChem CID65073031
Molecular FormulaC17H23N3
Molecular Weight269.39 g/mol
Exact Mass269.19
IUPAC NameN-(1-ethylazepan-4-yl)quinolin-8-amine
SMILESCCN1CCCC(Nc2cccc3cccnc23)CC1
InChIInChI=1S/C17H23N3/c1-2-20-12-5-8-15(10-13-20)19-16-9-3-6-14-7-4-11-18-17(14)16/h3-4,6-7,9,11,15,19H,2,5,8,10,12-13H2,1H3
InChIKeyOKZDQSRJSRUVHQ-UHFFFAOYSA-N
XLogP3.52
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-ethyl-N-(2-propan-2-yloxy-3-pyridinyl)azepan-4-amine
CID 65073239
N-(2,3-dichlorophenyl)-1-ethylazepan-4-amine
CID 65074283
1-ethyl-N-(2-quinolin-8-ylethyl)piperidin-4-amine
CID 81297387
N-(2-methyl-3-pyridinyl)-1-propylazepan-4-amine
CID 79041986
N-(1-ethylpiperidin-4-yl)pyrimidin-2-amine
CID 60667166
N-(2,6-difluorophenyl)-1-ethylazepan-4-amine
CID 65074729
N-(3,5-dimethylcyclohexyl)quinolin-8-amine
CID 64723380
1-ethyl-N-[2-(tetrazol-1-yl)phenyl]azepan-4-amine
CID 65074659
N-(2,4-dimethylphenyl)-1-ethylazepan-4-amine
CID 65072468
N-(2,3-dihydro-1H-inden-2-yl)quinolin-8-amine
CID 43512766
[1-[(Z,2E)-4-amino-2-(aminomethylidene)but-3-enyl]piperidin-4-yl]-[4-(quinolin-8-ylamino)piperidin-1-yl]methanone;ethane
CID 143382622
N-(3-bromophenyl)-1-ethylazepan-4-amine
CID 65072536

Frequently Asked Questions

What is the IUPAC name of N-(1-ethylazepan-4-yl)quinolin-8-amine?
The IUPAC name of N-(1-ethylazepan-4-yl)quinolin-8-amine (CID 65073031) is N-(1-ethylazepan-4-yl)quinolin-8-amine.
What is the SMILES notation for N-(1-ethylazepan-4-yl)quinolin-8-amine?
The canonical SMILES for N-(1-ethylazepan-4-yl)quinolin-8-amine is CCN1CCCC(Nc2cccc3cccnc23)CC1.
What is the InChIKey of N-(1-ethylazepan-4-yl)quinolin-8-amine?
The InChIKey is OKZDQSRJSRUVHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3/c1-2-20-12-5-8-15(10-13-20)19-16-9-3-6-14-7-4-11-18-17(14)16/h3-4,6-7,9,11,15,19H,2,5,8,10,12-13H2,1H3.
What are the key properties of N-(1-ethylazepan-4-yl)quinolin-8-amine?
N-(1-ethylazepan-4-yl)quinolin-8-amine has a molecular weight of 269.39 g/mol, XLogP of 3.52, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethylazepan-4-yl)quinolin-8-amine is sourced from PubChem (CID 65073031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).