4-(4-propan-2-ylpiperidin-1-yl)quinolin-7-amine

C17H23N3 — CID 103505187

IUPAC4-(4-propan-2-ylpiperidin-1-yl)quinolin-7-amine
SMILESCC(C)C1CCN(c2ccnc3cc(N)ccc23)CC1
InChIInChI=1S/C17H23N3/c1-12(2)13-6-9-20(10-7-13)17-5-8-19-16-11-14(18)3-4-15(16)17/h3-5,8,11-13H,6-7,9-10,18H2,1-2H3
InChIKeyQYOQJIGORVGUMR-UHFFFAOYSA-N
MW269.39 g/mol
LogP3.69
Rot. Bonds2

About 4-(4-propan-2-ylpiperidin-1-yl)quinolin-7-amine

4-(4-propan-2-ylpiperidin-1-yl)quinolin-7-amine (PubChem CID 103505187) has the molecular formula C17H23N3 and a molecular weight of 269.39 g/mol. Its IUPAC name is 4-(4-propan-2-ylpiperidin-1-yl)quinolin-7-amine.

Molecular Properties

Compound Name4-(4-propan-2-ylpiperidin-1-yl)quinolin-7-amine
PubChem CID103505187
Molecular FormulaC17H23N3
Molecular Weight269.39 g/mol
Exact Mass269.19
IUPAC Name4-(4-propan-2-ylpiperidin-1-yl)quinolin-7-amine
SMILESCC(C)C1CCN(c2ccnc3cc(N)ccc23)CC1
InChIInChI=1S/C17H23N3/c1-12(2)13-6-9-20(10-7-13)17-5-8-19-16-11-14(18)3-4-15(16)17/h3-5,8,11-13H,6-7,9-10,18H2,1-2H3
InChIKeyQYOQJIGORVGUMR-UHFFFAOYSA-N
XLogP3.69
TPSA42.15 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 ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-(4-propan-2-ylpiperidin-1-yl)quinolin-7-amine?
The IUPAC name of 4-(4-propan-2-ylpiperidin-1-yl)quinolin-7-amine (CID 103505187) is 4-(4-propan-2-ylpiperidin-1-yl)quinolin-7-amine.
What is the SMILES notation for 4-(4-propan-2-ylpiperidin-1-yl)quinolin-7-amine?
The canonical SMILES for 4-(4-propan-2-ylpiperidin-1-yl)quinolin-7-amine is CC(C)C1CCN(c2ccnc3cc(N)ccc23)CC1.
What is the InChIKey of 4-(4-propan-2-ylpiperidin-1-yl)quinolin-7-amine?
The InChIKey is QYOQJIGORVGUMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3/c1-12(2)13-6-9-20(10-7-13)17-5-8-19-16-11-14(18)3-4-15(16)17/h3-5,8,11-13H,6-7,9-10,18H2,1-2H3.
What are the key properties of 4-(4-propan-2-ylpiperidin-1-yl)quinolin-7-amine?
4-(4-propan-2-ylpiperidin-1-yl)quinolin-7-amine has a molecular weight of 269.39 g/mol, XLogP of 3.69, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-propan-2-ylpiperidin-1-yl)quinolin-7-amine is sourced from PubChem (CID 103505187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).