2-(6-chloro-3-pyridinyl)-4-methylpiperidin-1-amine

C11H16ClN3 — CID 141031290

IUPAC2-(6-chloro-3-pyridinyl)-4-methylpiperidin-1-amine
SMILESCC1CCN(N)C(c2ccc(Cl)nc2)C1
InChIInChI=1S/C11H16ClN3/c1-8-4-5-15(13)10(6-8)9-2-3-11(12)14-7-9/h2-3,7-8,10H,4-6,13H2,1H3
InChIKeyXUTVYUKMWMVDMN-UHFFFAOYSA-N
MW225.72 g/mol
LogP2.38
Rot. Bonds1

About 2-(6-chloro-3-pyridinyl)-4-methylpiperidin-1-amine

2-(6-chloro-3-pyridinyl)-4-methylpiperidin-1-amine (PubChem CID 141031290) has the molecular formula C11H16ClN3 and a molecular weight of 225.72 g/mol. Its IUPAC name is 2-(6-chloro-3-pyridinyl)-4-methylpiperidin-1-amine.

Molecular Properties

Compound Name2-(6-chloro-3-pyridinyl)-4-methylpiperidin-1-amine
PubChem CID141031290
Molecular FormulaC11H16ClN3
Molecular Weight225.72 g/mol
Exact Mass225.10
IUPAC Name2-(6-chloro-3-pyridinyl)-4-methylpiperidin-1-amine
SMILESCC1CCN(N)C(c2ccc(Cl)nc2)C1
InChIInChI=1S/C11H16ClN3/c1-8-4-5-15(13)10(6-8)9-2-3-11(12)14-7-9/h2-3,7-8,10H,4-6,13H2,1H3
InChIKeyXUTVYUKMWMVDMN-UHFFFAOYSA-N
XLogP2.38
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.72
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}

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Related Compounds

2-chloro-5-(1-propan-2-ylpyrrolidin-2-yl)pyridine
CID 102539185
2-(6-chloro-3-pyridinyl)-7-methyl-7-azabicyclo[2.2.1]heptane
CID 11601009
(1S,2R,3S,4R)-3-(6-chloro-3-pyridinyl)bicyclo[2.2.1]heptan-2-amine
CID 155556197
3-(6-chloro-3-pyridinyl)-1-methylpiperazine
CID 131537539
(1R,5S)-6-(6-chloro-3-pyridinyl)-8-methyl-8-azabicyclo[3.2.1]octane
CID 10728546
(1S,2S,4R)-2-(6-chloro-3-pyridinyl)bicyclo[2.2.1]heptan-7-amine
CID 11543114
(6-chloro-3-pyridinyl)-(4-methylazepan-1-yl)methanone
CID 55209897
2-(6-chloro-3-pyridinyl)-1,3,5,7-tetrazatricyclo[3.3.1.13,7]decane
CID 87516542
(6-chloro-3-pyridinyl)-(3-methylazetidin-1-yl)methanone
CID 162440321
2-chloro-5-[(2R)-2-methylsulfanylcyclopentyl]pyridine
CID 88937447
tert-butyl 3-(6-chloro-3-pyridinyl)-2-oxopyrrolidine-1-carboxylate
CID 118348145
2-chloro-5-[(2S)-piperidin-2-yl]pyridine;hydrochloride
CID 171194804

Frequently Asked Questions

What is the IUPAC name of 2-(6-chloro-3-pyridinyl)-4-methylpiperidin-1-amine?
The IUPAC name of 2-(6-chloro-3-pyridinyl)-4-methylpiperidin-1-amine (CID 141031290) is 2-(6-chloro-3-pyridinyl)-4-methylpiperidin-1-amine.
What is the SMILES notation for 2-(6-chloro-3-pyridinyl)-4-methylpiperidin-1-amine?
The canonical SMILES for 2-(6-chloro-3-pyridinyl)-4-methylpiperidin-1-amine is CC1CCN(N)C(c2ccc(Cl)nc2)C1.
What is the InChIKey of 2-(6-chloro-3-pyridinyl)-4-methylpiperidin-1-amine?
The InChIKey is XUTVYUKMWMVDMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16ClN3/c1-8-4-5-15(13)10(6-8)9-2-3-11(12)14-7-9/h2-3,7-8,10H,4-6,13H2,1H3.
What are the key properties of 2-(6-chloro-3-pyridinyl)-4-methylpiperidin-1-amine?
2-(6-chloro-3-pyridinyl)-4-methylpiperidin-1-amine has a molecular weight of 225.72 g/mol, XLogP of 2.38, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-chloro-3-pyridinyl)-4-methylpiperidin-1-amine is sourced from PubChem (CID 141031290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).