3-bromo-N-(2-methylpiperidin-3-yl)pyridin-4-amine

C11H16BrN3 — CID 114695454

IUPAC3-bromo-N-(2-methylpiperidin-3-yl)pyridin-4-amine
SMILESCC1NCCCC1Nc1ccncc1Br
InChIInChI=1S/C11H16BrN3/c1-8-10(3-2-5-14-8)15-11-4-6-13-7-9(11)12/h4,6-8,10,14H,2-3,5H2,1H3,(H,13,15)
InChIKeyGMWVNOSXWXRLIA-UHFFFAOYSA-N
MW270.17 g/mol
LogP2.40
Rot. Bonds2

About 3-bromo-N-(2-methylpiperidin-3-yl)pyridin-4-amine

3-bromo-N-(2-methylpiperidin-3-yl)pyridin-4-amine (PubChem CID 114695454) has the molecular formula C11H16BrN3 and a molecular weight of 270.17 g/mol. Its IUPAC name is 3-bromo-N-(2-methylpiperidin-3-yl)pyridin-4-amine.

Molecular Properties

Compound Name3-bromo-N-(2-methylpiperidin-3-yl)pyridin-4-amine
PubChem CID114695454
Molecular FormulaC11H16BrN3
Molecular Weight270.17 g/mol
Exact Mass269.05
IUPAC Name3-bromo-N-(2-methylpiperidin-3-yl)pyridin-4-amine
SMILESCC1NCCCC1Nc1ccncc1Br
InChIInChI=1S/C11H16BrN3/c1-8-10(3-2-5-14-8)15-11-4-6-13-7-9(11)12/h4,6-8,10,14H,2-3,5H2,1H3,(H,13,15)
InChIKeyGMWVNOSXWXRLIA-UHFFFAOYSA-N
XLogP2.40
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.17
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-bromo-N-[(1R,2R)-2-ethylsulfanylcyclopentyl]pyridin-4-amine
CID 124679598
N-(7-bicyclo[4.1.0]heptanyl)-3-bromopyridin-4-amine
CID 130909438
3,6-dichloro-N-(2-methylpiperidin-3-yl)pyridazin-4-amine
CID 114695592
N-(2-methylpiperidin-3-yl)-2-nitropyridin-3-amine
CID 114695322
4-N-(3-bromo-4-pyridinyl)cyclohexane-1,4-diamine
CID 104776650
5-iodo-N-(2-methylpiperidin-3-yl)pyrimidin-2-amine
CID 114695529
3-bromo-N-(4-propylcyclohexyl)pyridin-4-amine
CID 104776939
3-bromo-N-(1-cyclopentylethyl)pyridin-4-amine
CID 104777077
N-(5-bromo-4-fluoro-2-nitrophenyl)-2-methylpiperidin-3-amine
CID 114695324
3-bromo-N-(2-piperidin-3-ylethyl)pyridin-4-amine
CID 104777475
N-methyl-2-[(2-methylpiperidin-3-yl)amino]benzenesulfonamide
CID 114695588
2-methyl-N-(3-methyltriazol-4-yl)piperidin-3-amine
CID 130486758

Frequently Asked Questions

What is the IUPAC name of 3-bromo-N-(2-methylpiperidin-3-yl)pyridin-4-amine?
The IUPAC name of 3-bromo-N-(2-methylpiperidin-3-yl)pyridin-4-amine (CID 114695454) is 3-bromo-N-(2-methylpiperidin-3-yl)pyridin-4-amine.
What is the SMILES notation for 3-bromo-N-(2-methylpiperidin-3-yl)pyridin-4-amine?
The canonical SMILES for 3-bromo-N-(2-methylpiperidin-3-yl)pyridin-4-amine is CC1NCCCC1Nc1ccncc1Br.
What is the InChIKey of 3-bromo-N-(2-methylpiperidin-3-yl)pyridin-4-amine?
The InChIKey is GMWVNOSXWXRLIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16BrN3/c1-8-10(3-2-5-14-8)15-11-4-6-13-7-9(11)12/h4,6-8,10,14H,2-3,5H2,1H3,(H,13,15).
What are the key properties of 3-bromo-N-(2-methylpiperidin-3-yl)pyridin-4-amine?
3-bromo-N-(2-methylpiperidin-3-yl)pyridin-4-amine has a molecular weight of 270.17 g/mol, XLogP of 2.40, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-N-(2-methylpiperidin-3-yl)pyridin-4-amine is sourced from PubChem (CID 114695454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).