[4-(7-chloroquinolin-4-yl)-6-methylmorpholin-2-yl]methanamine

C15H18ClN3O — CID 102938625

IUPAC[4-(7-chloroquinolin-4-yl)-6-methylmorpholin-2-yl]methanamine
SMILESCC1CN(c2ccnc3cc(Cl)ccc23)CC(CN)O1
InChIInChI=1S/C15H18ClN3O/c1-10-8-19(9-12(7-17)20-10)15-4-5-18-14-6-11(16)2-3-13(14)15/h2-6,10,12H,7-9,17H2,1H3
InChIKeyVKFJWRDWZLVXRC-UHFFFAOYSA-N
MW291.78 g/mol
LogP2.44
Rot. Bonds2

About [4-(7-chloroquinolin-4-yl)-6-methylmorpholin-2-yl]methanamine

[4-(7-chloroquinolin-4-yl)-6-methylmorpholin-2-yl]methanamine (PubChem CID 102938625) has the molecular formula C15H18ClN3O and a molecular weight of 291.78 g/mol. Its IUPAC name is [4-(7-chloroquinolin-4-yl)-6-methylmorpholin-2-yl]methanamine.

Molecular Properties

Compound Name[4-(7-chloroquinolin-4-yl)-6-methylmorpholin-2-yl]methanamine
PubChem CID102938625
Molecular FormulaC15H18ClN3O
Molecular Weight291.78 g/mol
Exact Mass291.11
IUPAC Name[4-(7-chloroquinolin-4-yl)-6-methylmorpholin-2-yl]methanamine
SMILESCC1CN(c2ccnc3cc(Cl)ccc23)CC(CN)O1
InChIInChI=1S/C15H18ClN3O/c1-10-8-19(9-12(7-17)20-10)15-4-5-18-14-6-11(16)2-3-13(14)15/h2-6,10,12H,7-9,17H2,1H3
InChIKeyVKFJWRDWZLVXRC-UHFFFAOYSA-N
XLogP2.44
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.78
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(7-chloroquinolin-4-yl)-2-ethyl-6-methylmorpholine
CID 133299117
[4-(5-chloro-2-methylphenyl)-6-methylmorpholin-2-yl]methanamine
CID 82299005
1-(7-chloroquinolin-4-yl)azetidin-3-amine
CID 63759432
1-(7-chloroquinolin-4-yl)pyrrolidine-3,4-diol
CID 106673359
[4-(7-chloroquinolin-4-yl)morpholin-2-yl]methanol
CID 79839533
7-chloro-4-(3-methylpiperazin-1-yl)quinoline
CID 21101961
[4-(2,4-difluorophenyl)-6-methylmorpholin-2-yl]methanamine
CID 82293325
1-(7-chloroquinolin-4-yl)azepan-3-amine
CID 70760365
(4-isoquinolin-1-yl-6-methylmorpholin-2-yl)methanamine
CID 102938676
(3S,4S)-1-(7-chloroquinolin-4-yl)-3-(hydroxymethyl)piperidin-4-ol
CID 155498947
4-(3-bromopyrrolidin-1-yl)-7-chloroquinoline
CID 80669691
7-chloro-4-[4-[3-[4-[3-[4-[3-[4-(7-chloroquinolin-4-yl)piperazin-1-yl]propyl]piperazin-1-yl]propyl]piperazin-1-yl]propyl]piperazin-1-yl]quinoline
CID 11840452

Frequently Asked Questions

What is the IUPAC name of [4-(7-chloroquinolin-4-yl)-6-methylmorpholin-2-yl]methanamine?
The IUPAC name of [4-(7-chloroquinolin-4-yl)-6-methylmorpholin-2-yl]methanamine (CID 102938625) is [4-(7-chloroquinolin-4-yl)-6-methylmorpholin-2-yl]methanamine.
What is the SMILES notation for [4-(7-chloroquinolin-4-yl)-6-methylmorpholin-2-yl]methanamine?
The canonical SMILES for [4-(7-chloroquinolin-4-yl)-6-methylmorpholin-2-yl]methanamine is CC1CN(c2ccnc3cc(Cl)ccc23)CC(CN)O1.
What is the InChIKey of [4-(7-chloroquinolin-4-yl)-6-methylmorpholin-2-yl]methanamine?
The InChIKey is VKFJWRDWZLVXRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18ClN3O/c1-10-8-19(9-12(7-17)20-10)15-4-5-18-14-6-11(16)2-3-13(14)15/h2-6,10,12H,7-9,17H2,1H3.
What are the key properties of [4-(7-chloroquinolin-4-yl)-6-methylmorpholin-2-yl]methanamine?
[4-(7-chloroquinolin-4-yl)-6-methylmorpholin-2-yl]methanamine has a molecular weight of 291.78 g/mol, XLogP of 2.44, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(7-chloroquinolin-4-yl)-6-methylmorpholin-2-yl]methanamine is sourced from PubChem (CID 102938625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).