8-[[4-(dimethylamino)piperidin-1-yl]methyl]quinolin-5-amine

C17H24N4 — CID 43585624

IUPAC8-[[4-(dimethylamino)piperidin-1-yl]methyl]quinolin-5-amine
SMILESCN(C)C1CCN(Cc2ccc(N)c3cccnc23)CC1
InChIInChI=1S/C17H24N4/c1-20(2)14-7-10-21(11-8-14)12-13-5-6-16(18)15-4-3-9-19-17(13)15/h3-6,9,14H,7-8,10-12,18H2,1-2H3
InChIKeyPLYKXEREJPFDSP-UHFFFAOYSA-N
MW284.41 g/mol
LogP2.34
Rot. Bonds3

About 8-[[4-(dimethylamino)piperidin-1-yl]methyl]quinolin-5-amine

8-[[4-(dimethylamino)piperidin-1-yl]methyl]quinolin-5-amine (PubChem CID 43585624) has the molecular formula C17H24N4 and a molecular weight of 284.41 g/mol. Its IUPAC name is 8-[[4-(dimethylamino)piperidin-1-yl]methyl]quinolin-5-amine.

Molecular Properties

Compound Name8-[[4-(dimethylamino)piperidin-1-yl]methyl]quinolin-5-amine
PubChem CID43585624
Molecular FormulaC17H24N4
Molecular Weight284.41 g/mol
Exact Mass284.20
IUPAC Name8-[[4-(dimethylamino)piperidin-1-yl]methyl]quinolin-5-amine
SMILESCN(C)C1CCN(Cc2ccc(N)c3cccnc23)CC1
InChIInChI=1S/C17H24N4/c1-20(2)14-7-10-21(11-8-14)12-13-5-6-16(18)15-4-3-9-19-17(13)15/h3-6,9,14H,7-8,10-12,18H2,1-2H3
InChIKeyPLYKXEREJPFDSP-UHFFFAOYSA-N
XLogP2.34
TPSA45.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.41
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

8-[(4-methylpiperidin-1-yl)methyl]quinolin-5-amine
CID 43375420
1-[1-[(5-aminoquinolin-8-yl)methyl]piperidin-4-yl]ethanol
CID 106835491
1-[(5-aminoquinolin-8-yl)methyl]-3-methylpiperidin-4-ol
CID 114677852
8-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]quinolin-5-amine
CID 43375606
1-[(2-hydrazinyl-3-pyridinyl)methyl]-N,N-dimethylpiperidin-4-amine
CID 62471319
5-[4-(dimethylamino)piperidin-1-yl]quinolin-8-amine
CID 43585725
8-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)quinolin-5-amine
CID 63015654
1-[(5-aminoquinolin-8-yl)methyl]-3-methylimidazolidin-2-one
CID 62490120
8-[(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)methyl]quinolin-5-amine
CID 102882733
8-[[methoxy(methyl)amino]methyl]quinolin-5-amine
CID 43627608
1-[1-[(5-fluoroquinolin-8-yl)methyl]piperidin-4-yl]-N-methylmethanamine
CID 63249000
4-[(5-aminoquinolin-8-yl)methyl]morpholine-3,5-dione
CID 61311549

Frequently Asked Questions

What is the IUPAC name of 8-[[4-(dimethylamino)piperidin-1-yl]methyl]quinolin-5-amine?
The IUPAC name of 8-[[4-(dimethylamino)piperidin-1-yl]methyl]quinolin-5-amine (CID 43585624) is 8-[[4-(dimethylamino)piperidin-1-yl]methyl]quinolin-5-amine.
What is the SMILES notation for 8-[[4-(dimethylamino)piperidin-1-yl]methyl]quinolin-5-amine?
The canonical SMILES for 8-[[4-(dimethylamino)piperidin-1-yl]methyl]quinolin-5-amine is CN(C)C1CCN(Cc2ccc(N)c3cccnc23)CC1.
What is the InChIKey of 8-[[4-(dimethylamino)piperidin-1-yl]methyl]quinolin-5-amine?
The InChIKey is PLYKXEREJPFDSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4/c1-20(2)14-7-10-21(11-8-14)12-13-5-6-16(18)15-4-3-9-19-17(13)15/h3-6,9,14H,7-8,10-12,18H2,1-2H3.
What are the key properties of 8-[[4-(dimethylamino)piperidin-1-yl]methyl]quinolin-5-amine?
8-[[4-(dimethylamino)piperidin-1-yl]methyl]quinolin-5-amine has a molecular weight of 284.41 g/mol, XLogP of 2.34, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[[4-(dimethylamino)piperidin-1-yl]methyl]quinolin-5-amine is sourced from PubChem (CID 43585624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).