1-(4-amino-6-chloro-2-pyridinyl)-4-methylpiperidin-4-ol

C11H16ClN3O — CID 104924805

IUPAC1-(4-amino-6-chloro-2-pyridinyl)-4-methylpiperidin-4-ol
SMILESCC1(O)CCN(c2cc(N)cc(Cl)n2)CC1
InChIInChI=1S/C11H16ClN3O/c1-11(16)2-4-15(5-3-11)10-7-8(13)6-9(12)14-10/h6-7,16H,2-5H2,1H3,(H2,13,14)
InChIKeyRHNIMMUDWSFTRK-UHFFFAOYSA-N
MW241.72 g/mol
LogP1.67
Rot. Bonds1

About 1-(4-amino-6-chloro-2-pyridinyl)-4-methylpiperidin-4-ol

1-(4-amino-6-chloro-2-pyridinyl)-4-methylpiperidin-4-ol (PubChem CID 104924805) has the molecular formula C11H16ClN3O and a molecular weight of 241.72 g/mol. Its IUPAC name is 1-(4-amino-6-chloro-2-pyridinyl)-4-methylpiperidin-4-ol.

Molecular Properties

Compound Name1-(4-amino-6-chloro-2-pyridinyl)-4-methylpiperidin-4-ol
PubChem CID104924805
Molecular FormulaC11H16ClN3O
Molecular Weight241.72 g/mol
Exact Mass241.10
IUPAC Name1-(4-amino-6-chloro-2-pyridinyl)-4-methylpiperidin-4-ol
SMILESCC1(O)CCN(c2cc(N)cc(Cl)n2)CC1
InChIInChI=1S/C11H16ClN3O/c1-11(16)2-4-15(5-3-11)10-7-8(13)6-9(12)14-10/h6-7,16H,2-5H2,1H3,(H2,13,14)
InChIKeyRHNIMMUDWSFTRK-UHFFFAOYSA-N
XLogP1.67
TPSA62.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.72
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-chloro-6-(4-pyrimidin-2-ylpiperazin-1-yl)pyridin-4-amine
CID 104918719
1-(6-amino-3,5-dichloro-2-pyridinyl)-4-methylpiperidin-4-ol
CID 102759205
1-[6-chloro-2-(ethoxymethyl)pyrimidin-4-yl]-4-methylpiperidin-4-ol
CID 113401051
1-(2,6-diaminopyrimidin-4-yl)-4-methylazepan-4-ol
CID 107409100
1-(6-amino-2-ethylpyrimidin-4-yl)-4-methylpiperidin-4-ol
CID 81109427
2-chloro-6-[4-(3-methylphenyl)piperazin-1-yl]pyridin-4-amine
CID 104918819
4-(4-amino-6-chloro-2-pyridinyl)-1-methylpiperazin-2-one
CID 104924420
4-(4-amino-6-chloro-2-pyridinyl)piperazin-2-one
CID 104918759
[4-(4-amino-6-chloro-2-pyridinyl)-6,6-dimethylmorpholin-2-yl]methanol
CID 114070637
2-[1-(4-amino-6-chloro-2-pyridinyl)piperidin-4-yl]oxyethanol
CID 104925064
2-(4-benzylpiperazin-1-yl)-6-chloropyridin-4-amine
CID 104918654
1-(4-amino-5-methyl-2-pyridinyl)-4-methylpiperidin-4-ol
CID 83266355

Frequently Asked Questions

What is the IUPAC name of 1-(4-amino-6-chloro-2-pyridinyl)-4-methylpiperidin-4-ol?
The IUPAC name of 1-(4-amino-6-chloro-2-pyridinyl)-4-methylpiperidin-4-ol (CID 104924805) is 1-(4-amino-6-chloro-2-pyridinyl)-4-methylpiperidin-4-ol.
What is the SMILES notation for 1-(4-amino-6-chloro-2-pyridinyl)-4-methylpiperidin-4-ol?
The canonical SMILES for 1-(4-amino-6-chloro-2-pyridinyl)-4-methylpiperidin-4-ol is CC1(O)CCN(c2cc(N)cc(Cl)n2)CC1.
What is the InChIKey of 1-(4-amino-6-chloro-2-pyridinyl)-4-methylpiperidin-4-ol?
The InChIKey is RHNIMMUDWSFTRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16ClN3O/c1-11(16)2-4-15(5-3-11)10-7-8(13)6-9(12)14-10/h6-7,16H,2-5H2,1H3,(H2,13,14).
What are the key properties of 1-(4-amino-6-chloro-2-pyridinyl)-4-methylpiperidin-4-ol?
1-(4-amino-6-chloro-2-pyridinyl)-4-methylpiperidin-4-ol has a molecular weight of 241.72 g/mol, XLogP of 1.67, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-amino-6-chloro-2-pyridinyl)-4-methylpiperidin-4-ol is sourced from PubChem (CID 104924805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).