[4-[(2-methylquinolin-4-yl)methyl]morpholin-2-yl]methanamine

C16H21N3O — CID 79235234

IUPAC[4-[(2-methylquinolin-4-yl)methyl]morpholin-2-yl]methanamine
SMILESCc1cc(CN2CCOC(CN)C2)c2ccccc2n1
InChIInChI=1S/C16H21N3O/c1-12-8-13(15-4-2-3-5-16(15)18-12)10-19-6-7-20-14(9-17)11-19/h2-5,8,14H,6-7,9-11,17H2,1H3
InChIKeySODZNGCMCLPQCB-UHFFFAOYSA-N
MW271.36 g/mol
LogP1.70
Rot. Bonds3

About [4-[(2-methylquinolin-4-yl)methyl]morpholin-2-yl]methanamine

[4-[(2-methylquinolin-4-yl)methyl]morpholin-2-yl]methanamine (PubChem CID 79235234) has the molecular formula C16H21N3O and a molecular weight of 271.36 g/mol. Its IUPAC name is [4-[(2-methylquinolin-4-yl)methyl]morpholin-2-yl]methanamine.

Molecular Properties

Compound Name[4-[(2-methylquinolin-4-yl)methyl]morpholin-2-yl]methanamine
PubChem CID79235234
Molecular FormulaC16H21N3O
Molecular Weight271.36 g/mol
Exact Mass271.17
IUPAC Name[4-[(2-methylquinolin-4-yl)methyl]morpholin-2-yl]methanamine
SMILESCc1cc(CN2CCOC(CN)C2)c2ccccc2n1
InChIInChI=1S/C16H21N3O/c1-12-8-13(15-4-2-3-5-16(15)18-12)10-19-6-7-20-14(9-17)11-19/h2-5,8,14H,6-7,9-11,17H2,1H3
InChIKeySODZNGCMCLPQCB-UHFFFAOYSA-N
XLogP1.70
TPSA51.38 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 ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-methyl-1-[(2-methylquinolin-4-yl)methyl]piperidin-4-ol
CID 114502310
1-[(2-methylquinolin-4-yl)methyl]piperidin-3-amine
CID 79234789
[4-[[2-(methoxymethyl)phenyl]methyl]morpholin-2-yl]methanamine
CID 114397886
N-methyl-1-[(2-methylquinolin-4-yl)methyl]pyrrolidin-3-amine;dihydrochloride
CID 119905590
4-methyl-1-[(2-methylquinolin-4-yl)methyl]pyrrolidin-3-amine
CID 103575145
4-(3,9-diazabicyclo[4.2.1]nonan-3-ylmethyl)-2-methylquinoline
CID 81495492
[4-[(4-methyl-3-pyridinyl)methyl]morpholin-2-yl]methanamine;hydrochloride
CID 120844442
N-methyl-1-[(2-methylquinolin-4-yl)methyl]piperidin-3-amine;dihydrochloride
CID 119918724
[4-methyl-1-[(2-methylquinolin-4-yl)methyl]piperazin-2-yl]methanamine
CID 80503449
[4-[(2,3,4-trimethoxyphenyl)methyl]morpholin-2-yl]methanamine
CID 114393343
2-(bromomethyl)-4-(quinolin-4-ylmethyl)morpholine
CID 81213273
[4-[(1,3-dimethylpyrazol-4-yl)methyl]morpholin-2-yl]methanamine
CID 114393371

Frequently Asked Questions

What is the IUPAC name of [4-[(2-methylquinolin-4-yl)methyl]morpholin-2-yl]methanamine?
The IUPAC name of [4-[(2-methylquinolin-4-yl)methyl]morpholin-2-yl]methanamine (CID 79235234) is [4-[(2-methylquinolin-4-yl)methyl]morpholin-2-yl]methanamine.
What is the SMILES notation for [4-[(2-methylquinolin-4-yl)methyl]morpholin-2-yl]methanamine?
The canonical SMILES for [4-[(2-methylquinolin-4-yl)methyl]morpholin-2-yl]methanamine is Cc1cc(CN2CCOC(CN)C2)c2ccccc2n1.
What is the InChIKey of [4-[(2-methylquinolin-4-yl)methyl]morpholin-2-yl]methanamine?
The InChIKey is SODZNGCMCLPQCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O/c1-12-8-13(15-4-2-3-5-16(15)18-12)10-19-6-7-20-14(9-17)11-19/h2-5,8,14H,6-7,9-11,17H2,1H3.
What are the key properties of [4-[(2-methylquinolin-4-yl)methyl]morpholin-2-yl]methanamine?
[4-[(2-methylquinolin-4-yl)methyl]morpholin-2-yl]methanamine has a molecular weight of 271.36 g/mol, XLogP of 1.70, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(2-methylquinolin-4-yl)methyl]morpholin-2-yl]methanamine is sourced from PubChem (CID 79235234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).