2-methyl-N-[(4-methylmorpholin-3-yl)methyl]quinolin-4-amine

C16H21N3O — CID 154842506

IUPAC2-methyl-N-[(4-methylmorpholin-3-yl)methyl]quinolin-4-amine
SMILESCc1cc(NCC2COCCN2C)c2ccccc2n1
InChIInChI=1S/C16H21N3O/c1-12-9-16(14-5-3-4-6-15(14)18-12)17-10-13-11-20-8-7-19(13)2/h3-6,9,13H,7-8,10-11H2,1-2H3,(H,17,18)
InChIKeyQTKOJDQEQXJDAY-UHFFFAOYSA-N
MW271.36 g/mol
LogP2.29
Rot. Bonds3

About 2-methyl-N-[(4-methylmorpholin-3-yl)methyl]quinolin-4-amine

2-methyl-N-[(4-methylmorpholin-3-yl)methyl]quinolin-4-amine (PubChem CID 154842506) has the molecular formula C16H21N3O and a molecular weight of 271.36 g/mol. Its IUPAC name is 2-methyl-N-[(4-methylmorpholin-3-yl)methyl]quinolin-4-amine.

Molecular Properties

Compound Name2-methyl-N-[(4-methylmorpholin-3-yl)methyl]quinolin-4-amine
PubChem CID154842506
Molecular FormulaC16H21N3O
Molecular Weight271.36 g/mol
Exact Mass271.17
IUPAC Name2-methyl-N-[(4-methylmorpholin-3-yl)methyl]quinolin-4-amine
SMILESCc1cc(NCC2COCCN2C)c2ccccc2n1
InChIInChI=1S/C16H21N3O/c1-12-9-16(14-5-3-4-6-15(14)18-12)17-10-13-11-20-8-7-19(13)2/h3-6,9,13H,7-8,10-11H2,1-2H3,(H,17,18)
InChIKeyQTKOJDQEQXJDAY-UHFFFAOYSA-N
XLogP2.29
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-N-(morpholin-3-ylmethyl)quinolin-4-amine
CID 103549152
N-methyl-1-[4-(2-methylquinolin-4-yl)morpholin-3-yl]methanamine
CID 83105633
N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-2-methylquinolin-4-amine
CID 60858147
2-methyl-N-[(2-phenyloxolan-3-yl)methyl]quinolin-4-amine
CID 133353384
2-methyl-N-(3-piperidin-1-ylpropyl)quinolin-4-amine
CID 10859009
2-methyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]quinolin-4-amine
CID 97068034
bis(N,N'-bis(2-methylquinolin-4-yl)decane-1,10-diamine);bis(N,N'-bis(2-methylquinolin-4-yl)dodecane-1,12-diamine);hydrate
CID 158378182
N-[(3-aminocyclopentyl)methyl]-2-methylquinolin-4-amine
CID 106127195
N'-(2-methylquinolin-4-yl)ethane-1,2-diamine;dihydrochloride
CID 46735889
N-[2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-2-methylquinolin-4-amine
CID 71899447
2-methyl-N-(2-pyrazol-1-ylethyl)quinolin-4-amine
CID 61463009
2-methyl-N-(2-methyl-2-piperidin-1-ylpropyl)quinolin-4-amine
CID 71899453

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(4-methylmorpholin-3-yl)methyl]quinolin-4-amine?
The IUPAC name of 2-methyl-N-[(4-methylmorpholin-3-yl)methyl]quinolin-4-amine (CID 154842506) is 2-methyl-N-[(4-methylmorpholin-3-yl)methyl]quinolin-4-amine.
What is the SMILES notation for 2-methyl-N-[(4-methylmorpholin-3-yl)methyl]quinolin-4-amine?
The canonical SMILES for 2-methyl-N-[(4-methylmorpholin-3-yl)methyl]quinolin-4-amine is Cc1cc(NCC2COCCN2C)c2ccccc2n1.
What is the InChIKey of 2-methyl-N-[(4-methylmorpholin-3-yl)methyl]quinolin-4-amine?
The InChIKey is QTKOJDQEQXJDAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O/c1-12-9-16(14-5-3-4-6-15(14)18-12)17-10-13-11-20-8-7-19(13)2/h3-6,9,13H,7-8,10-11H2,1-2H3,(H,17,18).
What are the key properties of 2-methyl-N-[(4-methylmorpholin-3-yl)methyl]quinolin-4-amine?
2-methyl-N-[(4-methylmorpholin-3-yl)methyl]quinolin-4-amine has a molecular weight of 271.36 g/mol, XLogP of 2.29, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(4-methylmorpholin-3-yl)methyl]quinolin-4-amine is sourced from PubChem (CID 154842506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).