(4-aminopiperidin-1-yl)-quinolin-8-ylmethanone;dihydrochloride

C15H19Cl2N3O — CID 119375001

IUPAC(4-aminopiperidin-1-yl)-quinolin-8-ylmethanone;dihydrochloride
SMILESCl.Cl.NC1CCN(C(=O)c2cccc3cccnc23)CC1
InChIInChI=1S/C15H17N3O.2ClH/c16-12-6-9-18(10-7-12)15(19)13-5-1-3-11-4-2-8-17-14(11)13;;/h1-5,8,12H,6-7,9-10,16H2;2*1H
InChIKeyWHJAHLWHDBOPFG-UHFFFAOYSA-N
MW328.24 g/mol
LogP2.64
Rot. Bonds1

About (4-aminopiperidin-1-yl)-quinolin-8-ylmethanone;dihydrochloride

(4-aminopiperidin-1-yl)-quinolin-8-ylmethanone;dihydrochloride (PubChem CID 119375001) has the molecular formula C15H19Cl2N3O and a molecular weight of 328.24 g/mol. Its IUPAC name is (4-aminopiperidin-1-yl)-quinolin-8-ylmethanone;dihydrochloride.

Molecular Properties

Compound Name(4-aminopiperidin-1-yl)-quinolin-8-ylmethanone;dihydrochloride
PubChem CID119375001
Molecular FormulaC15H19Cl2N3O
Molecular Weight328.24 g/mol
Exact Mass327.09
IUPAC Name(4-aminopiperidin-1-yl)-quinolin-8-ylmethanone;dihydrochloride
SMILESCl.Cl.NC1CCN(C(=O)c2cccc3cccnc23)CC1
InChIInChI=1S/C15H17N3O.2ClH/c16-12-6-9-18(10-7-12)15(19)13-5-1-3-11-4-2-8-17-14(11)13;;/h1-5,8,12H,6-7,9-10,16H2;2*1H
InChIKeyWHJAHLWHDBOPFG-UHFFFAOYSA-N
XLogP2.64
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.24
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (4-aminopiperidin-1-yl)-quinolin-8-ylmethanone;dihydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[4-(methylamino)piperidin-1-yl]-quinolin-8-ylmethanone;dihydrochloride
CID 119562051
(3-hydroxypyrrolidin-1-yl)-quinolin-8-ylmethanone
CID 62917957
[4-(ethylaminomethyl)piperidin-1-yl]-quinolin-8-ylmethanone
CID 119646450
(3-amino-5-methylpiperidin-1-yl)-quinolin-8-ylmethanone
CID 79994421
[3-(aminomethyl)piperidin-1-yl]-quinolin-8-ylmethanone;dihydrochloride
CID 119464977
[4-(ethylamino)piperidin-1-yl]-quinolin-8-ylmethanone
CID 62851096
(3-hydroxypiperidin-1-yl)-quinolin-8-ylmethanone
CID 43415800
[3-(1-hydroxyethyl)pyrrolidin-1-yl]-quinolin-8-ylmethanone
CID 115966148
[3-(aminomethyl)-4-methylpiperidin-1-yl]-quinolin-8-ylmethanone
CID 114960494
2-[(3S)-1-(quinoline-8-carbonyl)pyrrolidin-3-yl]benzoic acid
CID 95725546
(3,5-dimethylpiperazin-1-yl)-quinolin-8-ylmethanone;dihydrochloride
CID 119564484
(3-methylpiperazin-1-yl)-quinolin-8-ylmethanone;dihydrochloride
CID 119578686

Frequently Asked Questions

What is the IUPAC name of (4-aminopiperidin-1-yl)-quinolin-8-ylmethanone;dihydrochloride?
The IUPAC name of (4-aminopiperidin-1-yl)-quinolin-8-ylmethanone;dihydrochloride (CID 119375001) is (4-aminopiperidin-1-yl)-quinolin-8-ylmethanone;dihydrochloride.
What is the SMILES notation for (4-aminopiperidin-1-yl)-quinolin-8-ylmethanone;dihydrochloride?
The canonical SMILES for (4-aminopiperidin-1-yl)-quinolin-8-ylmethanone;dihydrochloride is Cl.Cl.NC1CCN(C(=O)c2cccc3cccnc23)CC1.
What is the InChIKey of (4-aminopiperidin-1-yl)-quinolin-8-ylmethanone;dihydrochloride?
The InChIKey is WHJAHLWHDBOPFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O.2ClH/c16-12-6-9-18(10-7-12)15(19)13-5-1-3-11-4-2-8-17-14(11)13;;/h1-5,8,12H,6-7,9-10,16H2;2*1H.
What are the key properties of (4-aminopiperidin-1-yl)-quinolin-8-ylmethanone;dihydrochloride?
(4-aminopiperidin-1-yl)-quinolin-8-ylmethanone;dihydrochloride has a molecular weight of 328.24 g/mol, XLogP of 2.64, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-aminopiperidin-1-yl)-quinolin-8-ylmethanone;dihydrochloride is sourced from PubChem (CID 119375001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).