1-[4-(quinolin-4-ylmethyl)morpholin-2-yl]ethanamine

C16H21N3O — CID 115314848

IUPAC1-[4-(quinolin-4-ylmethyl)morpholin-2-yl]ethanamine
SMILESCC(N)C1CN(Cc2ccnc3ccccc23)CCO1
InChIInChI=1S/C16H21N3O/c1-12(17)16-11-19(8-9-20-16)10-13-6-7-18-15-5-3-2-4-14(13)15/h2-7,12,16H,8-11,17H2,1H3
InChIKeyDBFUKWVZMXPNQT-UHFFFAOYSA-N
MW271.36 g/mol
LogP1.78
Rot. Bonds3

About 1-[4-(quinolin-4-ylmethyl)morpholin-2-yl]ethanamine

1-[4-(quinolin-4-ylmethyl)morpholin-2-yl]ethanamine (PubChem CID 115314848) has the molecular formula C16H21N3O and a molecular weight of 271.36 g/mol. Its IUPAC name is 1-[4-(quinolin-4-ylmethyl)morpholin-2-yl]ethanamine.

Molecular Properties

Compound Name1-[4-(quinolin-4-ylmethyl)morpholin-2-yl]ethanamine
PubChem CID115314848
Molecular FormulaC16H21N3O
Molecular Weight271.36 g/mol
Exact Mass271.17
IUPAC Name1-[4-(quinolin-4-ylmethyl)morpholin-2-yl]ethanamine
SMILESCC(N)C1CN(Cc2ccnc3ccccc23)CCO1
InChIInChI=1S/C16H21N3O/c1-12(17)16-11-19(8-9-20-16)10-13-6-7-18-15-5-3-2-4-14(13)15/h2-7,12,16H,8-11,17H2,1H3
InChIKeyDBFUKWVZMXPNQT-UHFFFAOYSA-N
XLogP1.78
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 ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[4-(1H-indol-3-ylmethyl)morpholin-2-yl]ethanamine
CID 115314840
2-(bromomethyl)-4-(quinolin-4-ylmethyl)morpholine
CID 81213273
(1S)-1-[(2S)-4-benzylmorpholin-2-yl]ethanamine
CID 95396414
N'-hydroxy-4-(quinolin-4-ylmethyl)morpholine-2-carboximidamide
CID 79670534
1-[4-[(4-chloro-2-pyridinyl)methyl]morpholin-2-yl]ethanamine
CID 115315468
1-[4-[(2-nitrophenyl)methyl]morpholin-2-yl]ethanamine
CID 81490216
1-[4-[(1,3-dimethylindol-2-yl)methyl]morpholin-2-yl]ethanamine
CID 107236440
4-[[4-(1-chloroethyl)piperidin-1-yl]methyl]quinoline
CID 106838033
1-[4-[(3,4-dichlorophenyl)methyl]morpholin-2-yl]ethanamine
CID 81490139
4-[(3-butan-2-ylpiperazin-1-yl)methyl]quinoline
CID 79232784
4-[(1R)-1-[1-(quinolin-4-ylmethyl)piperidin-4-yl]ethyl]morpholine
CID 95144633
1-[4-[(4-pyrazol-1-ylphenyl)methyl]morpholin-2-yl]ethanamine
CID 81497211

Frequently Asked Questions

What is the IUPAC name of 1-[4-(quinolin-4-ylmethyl)morpholin-2-yl]ethanamine?
The IUPAC name of 1-[4-(quinolin-4-ylmethyl)morpholin-2-yl]ethanamine (CID 115314848) is 1-[4-(quinolin-4-ylmethyl)morpholin-2-yl]ethanamine.
What is the SMILES notation for 1-[4-(quinolin-4-ylmethyl)morpholin-2-yl]ethanamine?
The canonical SMILES for 1-[4-(quinolin-4-ylmethyl)morpholin-2-yl]ethanamine is CC(N)C1CN(Cc2ccnc3ccccc23)CCO1.
What is the InChIKey of 1-[4-(quinolin-4-ylmethyl)morpholin-2-yl]ethanamine?
The InChIKey is DBFUKWVZMXPNQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O/c1-12(17)16-11-19(8-9-20-16)10-13-6-7-18-15-5-3-2-4-14(13)15/h2-7,12,16H,8-11,17H2,1H3.
What are the key properties of 1-[4-(quinolin-4-ylmethyl)morpholin-2-yl]ethanamine?
1-[4-(quinolin-4-ylmethyl)morpholin-2-yl]ethanamine has a molecular weight of 271.36 g/mol, XLogP of 1.78, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(quinolin-4-ylmethyl)morpholin-2-yl]ethanamine is sourced from PubChem (CID 115314848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).