N,N-dimethyl-1-[(quinolin-8-ylmethylamino)methyl]cyclobutan-1-amine

C17H23N3 — CID 105415743

IUPACN,N-dimethyl-1-[(quinolin-8-ylmethylamino)methyl]cyclobutan-1-amine
SMILESCN(C)C1(CNCc2cccc3cccnc23)CCC1
InChIInChI=1S/C17H23N3/c1-20(2)17(9-5-10-17)13-18-12-15-7-3-6-14-8-4-11-19-16(14)15/h3-4,6-8,11,18H,5,9-10,12-13H2,1-2H3
InChIKeyLXQWBNAFNXSGSG-UHFFFAOYSA-N
MW269.39 g/mol
LogP2.81
Rot. Bonds5

About N,N-dimethyl-1-[(quinolin-8-ylmethylamino)methyl]cyclobutan-1-amine

N,N-dimethyl-1-[(quinolin-8-ylmethylamino)methyl]cyclobutan-1-amine (PubChem CID 105415743) has the molecular formula C17H23N3 and a molecular weight of 269.39 g/mol. Its IUPAC name is N,N-dimethyl-1-[(quinolin-8-ylmethylamino)methyl]cyclobutan-1-amine.

Molecular Properties

Compound NameN,N-dimethyl-1-[(quinolin-8-ylmethylamino)methyl]cyclobutan-1-amine
PubChem CID105415743
Molecular FormulaC17H23N3
Molecular Weight269.39 g/mol
Exact Mass269.19
IUPAC NameN,N-dimethyl-1-[(quinolin-8-ylmethylamino)methyl]cyclobutan-1-amine
SMILESCN(C)C1(CNCc2cccc3cccnc23)CCC1
InChIInChI=1S/C17H23N3/c1-20(2)17(9-5-10-17)13-18-12-15-7-3-6-14-8-4-11-19-16(14)15/h3-4,6-8,11,18H,5,9-10,12-13H2,1-2H3
InChIKeyLXQWBNAFNXSGSG-UHFFFAOYSA-N
XLogP2.81
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1-methylcyclopentyl)methyl]-1-quinolin-8-ylmethanamine
CID 63821632
N-[(1-cyclopropylcyclopropyl)methyl]-1-quinolin-8-ylmethanamine
CID 103838629
N-[(3-methyloxetan-3-yl)methyl]-1-quinolin-8-ylmethanamine
CID 78957176
N'-cyclopentyl-N'-methyl-N-(quinolin-8-ylmethyl)ethane-1,2-diamine
CID 63314495
N,N-dimethyl-1-[(quinolin-6-ylmethylamino)methyl]cyclobutan-1-amine
CID 105414996
1-cyclobutyl-N-(quinolin-8-ylmethyl)methanamine
CID 43298300
3-[[[1-(dimethylamino)cyclobutyl]methylamino]methyl]benzene-1,2-diol
CID 105415267
2-methyl-N-(quinolin-8-ylmethyl)propan-2-amine
CID 28608485
N,N-dimethyl-1-[[(2-methylphenyl)methylamino]methyl]cyclopentan-1-amine
CID 78912363
1-(2,3-dimethylphenyl)-N-(quinolin-8-ylmethyl)methanamine
CID 78980832
N-(quinolin-8-ylmethyl)butan-1-amine
CID 28613793
2-[[[1-(dimethylamino)cyclopentyl]methylamino]methyl]aniline
CID 83117063

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[(quinolin-8-ylmethylamino)methyl]cyclobutan-1-amine?
The IUPAC name of N,N-dimethyl-1-[(quinolin-8-ylmethylamino)methyl]cyclobutan-1-amine (CID 105415743) is N,N-dimethyl-1-[(quinolin-8-ylmethylamino)methyl]cyclobutan-1-amine.
What is the SMILES notation for N,N-dimethyl-1-[(quinolin-8-ylmethylamino)methyl]cyclobutan-1-amine?
The canonical SMILES for N,N-dimethyl-1-[(quinolin-8-ylmethylamino)methyl]cyclobutan-1-amine is CN(C)C1(CNCc2cccc3cccnc23)CCC1.
What is the InChIKey of N,N-dimethyl-1-[(quinolin-8-ylmethylamino)methyl]cyclobutan-1-amine?
The InChIKey is LXQWBNAFNXSGSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3/c1-20(2)17(9-5-10-17)13-18-12-15-7-3-6-14-8-4-11-19-16(14)15/h3-4,6-8,11,18H,5,9-10,12-13H2,1-2H3.
What are the key properties of N,N-dimethyl-1-[(quinolin-8-ylmethylamino)methyl]cyclobutan-1-amine?
N,N-dimethyl-1-[(quinolin-8-ylmethylamino)methyl]cyclobutan-1-amine has a molecular weight of 269.39 g/mol, XLogP of 2.81, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-[(quinolin-8-ylmethylamino)methyl]cyclobutan-1-amine is sourced from PubChem (CID 105415743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).