[4-(5-bromo-3-chloro-2-pyridinyl)-6-methylmorpholin-2-yl]methanamine

C11H15BrClN3O — CID 103584271

IUPAC[4-(5-bromo-3-chloro-2-pyridinyl)-6-methylmorpholin-2-yl]methanamine
SMILESCC1CN(c2ncc(Br)cc2Cl)CC(CN)O1
InChIInChI=1S/C11H15BrClN3O/c1-7-5-16(6-9(3-14)17-7)11-10(13)2-8(12)4-15-11/h2,4,7,9H,3,5-6,14H2,1H3
InChIKeyRWBQVWLWVHTVAN-UHFFFAOYSA-N
MW320.62 g/mol
LogP2.05
Rot. Bonds2

About [4-(5-bromo-3-chloro-2-pyridinyl)-6-methylmorpholin-2-yl]methanamine

[4-(5-bromo-3-chloro-2-pyridinyl)-6-methylmorpholin-2-yl]methanamine (PubChem CID 103584271) has the molecular formula C11H15BrClN3O and a molecular weight of 320.62 g/mol. Its IUPAC name is [4-(5-bromo-3-chloro-2-pyridinyl)-6-methylmorpholin-2-yl]methanamine.

Molecular Properties

Compound Name[4-(5-bromo-3-chloro-2-pyridinyl)-6-methylmorpholin-2-yl]methanamine
PubChem CID103584271
Molecular FormulaC11H15BrClN3O
Molecular Weight320.62 g/mol
Exact Mass319.01
IUPAC Name[4-(5-bromo-3-chloro-2-pyridinyl)-6-methylmorpholin-2-yl]methanamine
SMILESCC1CN(c2ncc(Br)cc2Cl)CC(CN)O1
InChIInChI=1S/C11H15BrClN3O/c1-7-5-16(6-9(3-14)17-7)11-10(13)2-8(12)4-15-11/h2,4,7,9H,3,5-6,14H2,1H3
InChIKeyRWBQVWLWVHTVAN-UHFFFAOYSA-N
XLogP2.05
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.62
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(5-bromo-3-chloro-2-pyridinyl)-2-(chloromethyl)-6-methylmorpholine
CID 103584209
4-(5-bromo-3-chloro-2-pyridinyl)-2-(bromomethyl)-6-methylmorpholine
CID 103584210
[1-(5-bromo-3-chloro-2-pyridinyl)azetidin-3-yl]methanamine
CID 103584239
[5-bromo-2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-3-pyridinyl]methanamine
CID 104960830
2-(bromomethyl)-4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-6-methylmorpholine
CID 102937213
1-(5-bromo-3-chloro-2-pyridinyl)-5-methylpiperidin-3-amine
CID 103582851
[1-(5-bromo-3-methyl-2-pyridinyl)azetidin-3-yl]methanamine
CID 79717951
[6-methyl-4-(1,3-thiazol-2-yl)morpholin-2-yl]methanamine
CID 102938684
2-(bromomethyl)-4-(3-bromo-5-methyl-2-pyridinyl)-6-methylmorpholine
CID 102937171
[4-(5-chloro-2-methylphenyl)-6-methylmorpholin-2-yl]methanamine
CID 82299005
(4-isoquinolin-1-yl-6-methylmorpholin-2-yl)methanamine
CID 102938676
[6-methyl-4-(2,4,6-trimethylphenyl)morpholin-2-yl]methanamine
CID 82296607

Frequently Asked Questions

What is the IUPAC name of [4-(5-bromo-3-chloro-2-pyridinyl)-6-methylmorpholin-2-yl]methanamine?
The IUPAC name of [4-(5-bromo-3-chloro-2-pyridinyl)-6-methylmorpholin-2-yl]methanamine (CID 103584271) is [4-(5-bromo-3-chloro-2-pyridinyl)-6-methylmorpholin-2-yl]methanamine.
What is the SMILES notation for [4-(5-bromo-3-chloro-2-pyridinyl)-6-methylmorpholin-2-yl]methanamine?
The canonical SMILES for [4-(5-bromo-3-chloro-2-pyridinyl)-6-methylmorpholin-2-yl]methanamine is CC1CN(c2ncc(Br)cc2Cl)CC(CN)O1.
What is the InChIKey of [4-(5-bromo-3-chloro-2-pyridinyl)-6-methylmorpholin-2-yl]methanamine?
The InChIKey is RWBQVWLWVHTVAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15BrClN3O/c1-7-5-16(6-9(3-14)17-7)11-10(13)2-8(12)4-15-11/h2,4,7,9H,3,5-6,14H2,1H3.
What are the key properties of [4-(5-bromo-3-chloro-2-pyridinyl)-6-methylmorpholin-2-yl]methanamine?
[4-(5-bromo-3-chloro-2-pyridinyl)-6-methylmorpholin-2-yl]methanamine has a molecular weight of 320.62 g/mol, XLogP of 2.05, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(5-bromo-3-chloro-2-pyridinyl)-6-methylmorpholin-2-yl]methanamine is sourced from PubChem (CID 103584271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).