3-[(4-ethylpiperidin-1-yl)methyl]quinolin-2-amine

C17H23N3 — CID 62207764

IUPAC3-[(4-ethylpiperidin-1-yl)methyl]quinolin-2-amine
SMILESCCC1CCN(Cc2cc3ccccc3nc2N)CC1
InChIInChI=1S/C17H23N3/c1-2-13-7-9-20(10-8-13)12-15-11-14-5-3-4-6-16(14)19-17(15)18/h3-6,11,13H,2,7-10,12H2,1H3,(H2,18,19)
InChIKeyWCXQDIIIFBRPIH-UHFFFAOYSA-N
MW269.39 g/mol
LogP3.44
Rot. Bonds3

About 3-[(4-ethylpiperidin-1-yl)methyl]quinolin-2-amine

3-[(4-ethylpiperidin-1-yl)methyl]quinolin-2-amine (PubChem CID 62207764) has the molecular formula C17H23N3 and a molecular weight of 269.39 g/mol. Its IUPAC name is 3-[(4-ethylpiperidin-1-yl)methyl]quinolin-2-amine.

Molecular Properties

Compound Name3-[(4-ethylpiperidin-1-yl)methyl]quinolin-2-amine
PubChem CID62207764
Molecular FormulaC17H23N3
Molecular Weight269.39 g/mol
Exact Mass269.19
IUPAC Name3-[(4-ethylpiperidin-1-yl)methyl]quinolin-2-amine
SMILESCCC1CCN(Cc2cc3ccccc3nc2N)CC1
InChIInChI=1S/C17H23N3/c1-2-13-7-9-20(10-8-13)12-15-11-14-5-3-4-6-16(14)19-17(15)18/h3-6,11,13H,2,7-10,12H2,1H3,(H2,18,19)
InChIKeyWCXQDIIIFBRPIH-UHFFFAOYSA-N
XLogP3.44
TPSA42.15 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 ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(pyrrolidin-1-ylmethyl)quinolin-2-amine
CID 55046492
3-[(4-methylpiperazin-1-yl)methyl]quinolin-2-amine
CID 62178935
1-[1-[(2-aminoquinolin-3-yl)methyl]pyrrolidin-3-yl]ethanol
CID 115967098
1-[(2-aminoquinolin-3-yl)methyl]-3-methylpiperidin-4-ol
CID 114681766
3-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]quinolin-2-amine
CID 62182409
2-chloro-3-[(4-propylpiperidin-1-yl)methyl]quinoline
CID 63479216
3-[(3,4-dimethylpiperazin-1-yl)methyl]quinolin-2-amine
CID 63634223
[2-(4-ethylpiperidin-1-yl)quinolin-3-yl]methanol
CID 61421257
[3-[(4-methylpiperidin-1-yl)methyl]quinolin-2-yl]hydrazine
CID 62246122
[1-[(2-chloroquinolin-3-yl)methyl]pyrrolidin-3-yl]methanamine
CID 62062000
[1-[(2-aminoquinolin-3-yl)methyl]pyrrolidin-2-yl]methanol
CID 62207536
3-[(3-methoxy-3-methylpiperidin-1-yl)methyl]quinolin-2-amine
CID 107394991

Frequently Asked Questions

What is the IUPAC name of 3-[(4-ethylpiperidin-1-yl)methyl]quinolin-2-amine?
The IUPAC name of 3-[(4-ethylpiperidin-1-yl)methyl]quinolin-2-amine (CID 62207764) is 3-[(4-ethylpiperidin-1-yl)methyl]quinolin-2-amine.
What is the SMILES notation for 3-[(4-ethylpiperidin-1-yl)methyl]quinolin-2-amine?
The canonical SMILES for 3-[(4-ethylpiperidin-1-yl)methyl]quinolin-2-amine is CCC1CCN(Cc2cc3ccccc3nc2N)CC1.
What is the InChIKey of 3-[(4-ethylpiperidin-1-yl)methyl]quinolin-2-amine?
The InChIKey is WCXQDIIIFBRPIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3/c1-2-13-7-9-20(10-8-13)12-15-11-14-5-3-4-6-16(14)19-17(15)18/h3-6,11,13H,2,7-10,12H2,1H3,(H2,18,19).
What are the key properties of 3-[(4-ethylpiperidin-1-yl)methyl]quinolin-2-amine?
3-[(4-ethylpiperidin-1-yl)methyl]quinolin-2-amine has a molecular weight of 269.39 g/mol, XLogP of 3.44, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-ethylpiperidin-1-yl)methyl]quinolin-2-amine is sourced from PubChem (CID 62207764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).