8-[(dibutylamino)methyl]quinolin-5-amine

C18H27N3 — CID 43375839

IUPAC8-[(dibutylamino)methyl]quinolin-5-amine
SMILESCCCCN(CCCC)Cc1ccc(N)c2cccnc12
InChIInChI=1S/C18H27N3/c1-3-5-12-21(13-6-4-2)14-15-9-10-17(19)16-8-7-11-20-18(15)16/h7-11H,3-6,12-14,19H2,1-2H3
InChIKeyFNIQNZVKDFEHLU-UHFFFAOYSA-N
MW285.44 g/mol
LogP4.22
Rot. Bonds8

About 8-[(dibutylamino)methyl]quinolin-5-amine

8-[(dibutylamino)methyl]quinolin-5-amine (PubChem CID 43375839) has the molecular formula C18H27N3 and a molecular weight of 285.44 g/mol. Its IUPAC name is 8-[(dibutylamino)methyl]quinolin-5-amine.

Molecular Properties

Compound Name8-[(dibutylamino)methyl]quinolin-5-amine
PubChem CID43375839
Molecular FormulaC18H27N3
Molecular Weight285.44 g/mol
Exact Mass285.22
IUPAC Name8-[(dibutylamino)methyl]quinolin-5-amine
SMILESCCCCN(CCCC)Cc1ccc(N)c2cccnc12
InChIInChI=1S/C18H27N3/c1-3-5-12-21(13-6-4-2)14-15-9-10-17(19)16-8-7-11-20-18(15)16/h7-11H,3-6,12-14,19H2,1-2H3
InChIKeyFNIQNZVKDFEHLU-UHFFFAOYSA-N
XLogP4.22
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.44
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

8-[[ethyl(2-methylpropyl)amino]methyl]quinolin-5-amine
CID 43375996
8-[[methoxy(methyl)amino]methyl]quinolin-5-amine
CID 43627608
5,7-bis[(dibutylamino)methyl]quinolin-8-ol
CID 71405853
8-[[butan-2-yl(ethyl)amino]methyl]quinolin-5-amine
CID 43376007
8-[[benzyl(methyl)amino]methyl]quinolin-5-amine
CID 43375712
4,6-bis[(dibutylamino)methyl]benzene-1,3-diamine
CID 139658926
1-[(5-aminoquinolin-8-yl)methyl-methylamino]propan-2-ol
CID 62334736
8-[[1-methoxypropan-2-yl(methyl)amino]methyl]quinolin-5-amine
CID 61450348
4-[(5-aminoquinolin-8-yl)methyl-methylamino]phenol
CID 107733762
3-[(5-aminoquinolin-8-yl)methyl-methylamino]butanenitrile
CID 55174134
5-amino-N-butyl-N-ethylquinoline-8-sulfonamide
CID 104850310
N-butyl-N-[(2-hydrazinyl-3-pyridinyl)methyl]butan-1-amine
CID 62470497

Frequently Asked Questions

What is the IUPAC name of 8-[(dibutylamino)methyl]quinolin-5-amine?
The IUPAC name of 8-[(dibutylamino)methyl]quinolin-5-amine (CID 43375839) is 8-[(dibutylamino)methyl]quinolin-5-amine.
What is the SMILES notation for 8-[(dibutylamino)methyl]quinolin-5-amine?
The canonical SMILES for 8-[(dibutylamino)methyl]quinolin-5-amine is CCCCN(CCCC)Cc1ccc(N)c2cccnc12.
What is the InChIKey of 8-[(dibutylamino)methyl]quinolin-5-amine?
The InChIKey is FNIQNZVKDFEHLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27N3/c1-3-5-12-21(13-6-4-2)14-15-9-10-17(19)16-8-7-11-20-18(15)16/h7-11H,3-6,12-14,19H2,1-2H3.
What are the key properties of 8-[(dibutylamino)methyl]quinolin-5-amine?
8-[(dibutylamino)methyl]quinolin-5-amine has a molecular weight of 285.44 g/mol, XLogP of 4.22, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[(dibutylamino)methyl]quinolin-5-amine is sourced from PubChem (CID 43375839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).