1-(5-bromo-3-chloro-2-pyridinyl)-5-methylpiperidin-3-amine

C11H15BrClN3 — CID 103582851

IUPAC1-(5-bromo-3-chloro-2-pyridinyl)-5-methylpiperidin-3-amine
SMILESCC1CC(N)CN(c2ncc(Br)cc2Cl)C1
InChIInChI=1S/C11H15BrClN3/c1-7-2-9(14)6-16(5-7)11-10(13)3-8(12)4-15-11/h3-4,7,9H,2,5-6,14H2,1H3
InChIKeyOTDMRRJGMXBBCL-UHFFFAOYSA-N
MW304.62 g/mol
LogP2.67
Rot. Bonds1

About 1-(5-bromo-3-chloro-2-pyridinyl)-5-methylpiperidin-3-amine

1-(5-bromo-3-chloro-2-pyridinyl)-5-methylpiperidin-3-amine (PubChem CID 103582851) has the molecular formula C11H15BrClN3 and a molecular weight of 304.62 g/mol. Its IUPAC name is 1-(5-bromo-3-chloro-2-pyridinyl)-5-methylpiperidin-3-amine.

Molecular Properties

Compound Name1-(5-bromo-3-chloro-2-pyridinyl)-5-methylpiperidin-3-amine
PubChem CID103582851
Molecular FormulaC11H15BrClN3
Molecular Weight304.62 g/mol
Exact Mass303.01
IUPAC Name1-(5-bromo-3-chloro-2-pyridinyl)-5-methylpiperidin-3-amine
SMILESCC1CC(N)CN(c2ncc(Br)cc2Cl)C1
InChIInChI=1S/C11H15BrClN3/c1-7-2-9(14)6-16(5-7)11-10(13)3-8(12)4-15-11/h3-4,7,9H,2,5-6,14H2,1H3
InChIKeyOTDMRRJGMXBBCL-UHFFFAOYSA-N
XLogP2.67
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.62
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-bromo-5-chloro-2-pyridinyl)-5-methylpiperidin-3-amine
CID 114836358
[1-(5-bromo-3-chloro-2-pyridinyl)azetidin-3-yl]methanamine
CID 103584239
[4-(5-bromo-3-chloro-2-pyridinyl)-6-methylmorpholin-2-yl]methanamine
CID 103584271
[5-chloro-6-(3,5-dimethylpiperidin-1-yl)-3-pyridinyl]methanamine
CID 62300014
4-(5-bromo-3-chloro-2-pyridinyl)-2-(chloromethyl)-6-methylmorpholine
CID 103584209
1-(3-bromo-5-nitro-2-pyridinyl)-5-methylpiperidin-3-amine
CID 79994412
4-(5-bromo-3-chloro-2-pyridinyl)-2-(bromomethyl)-6-methylmorpholine
CID 103584210
1-(5-bromo-4-methyl-2-pyridinyl)-5-methylpiperidin-3-amine
CID 114869589
5-bromo-3-chloro-2-[3-(pyridin-3-yloxymethyl)azetidin-1-yl]pyridine
CID 163357183
(3S)-1-(5-bromo-3-chloro-2-pyridinyl)pyrrolidin-3-ol
CID 103580205
1-[1-(5-bromo-3-chloro-2-pyridinyl)piperidin-4-yl]ethanamine
CID 103582784
5-bromo-3-chloro-2-[(2S,6R)-2,6-dimethylpiperidin-1-yl]pyridine
CID 103583473

Frequently Asked Questions

What is the IUPAC name of 1-(5-bromo-3-chloro-2-pyridinyl)-5-methylpiperidin-3-amine?
The IUPAC name of 1-(5-bromo-3-chloro-2-pyridinyl)-5-methylpiperidin-3-amine (CID 103582851) is 1-(5-bromo-3-chloro-2-pyridinyl)-5-methylpiperidin-3-amine.
What is the SMILES notation for 1-(5-bromo-3-chloro-2-pyridinyl)-5-methylpiperidin-3-amine?
The canonical SMILES for 1-(5-bromo-3-chloro-2-pyridinyl)-5-methylpiperidin-3-amine is CC1CC(N)CN(c2ncc(Br)cc2Cl)C1.
What is the InChIKey of 1-(5-bromo-3-chloro-2-pyridinyl)-5-methylpiperidin-3-amine?
The InChIKey is OTDMRRJGMXBBCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15BrClN3/c1-7-2-9(14)6-16(5-7)11-10(13)3-8(12)4-15-11/h3-4,7,9H,2,5-6,14H2,1H3.
What are the key properties of 1-(5-bromo-3-chloro-2-pyridinyl)-5-methylpiperidin-3-amine?
1-(5-bromo-3-chloro-2-pyridinyl)-5-methylpiperidin-3-amine has a molecular weight of 304.62 g/mol, XLogP of 2.67, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-bromo-3-chloro-2-pyridinyl)-5-methylpiperidin-3-amine is sourced from PubChem (CID 103582851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).