2-[[(6-amino-3,5-dichloro-2-pyridinyl)amino]methyl]cyclohexan-1-ol

C12H17Cl2N3O — CID 102758635

IUPAC2-[[(6-amino-3,5-dichloro-2-pyridinyl)amino]methyl]cyclohexan-1-ol
SMILESNc1nc(NCC2CCCCC2O)c(Cl)cc1Cl
InChIInChI=1S/C12H17Cl2N3O/c13-8-5-9(14)12(17-11(8)15)16-6-7-3-1-2-4-10(7)18/h5,7,10,18H,1-4,6H2,(H3,15,16,17)
InChIKeyXUUARSJNHOEXMG-UHFFFAOYSA-N
MW290.19 g/mol
LogP2.93
Rot. Bonds3

About 2-[[(6-amino-3,5-dichloro-2-pyridinyl)amino]methyl]cyclohexan-1-ol

2-[[(6-amino-3,5-dichloro-2-pyridinyl)amino]methyl]cyclohexan-1-ol (PubChem CID 102758635) has the molecular formula C12H17Cl2N3O and a molecular weight of 290.19 g/mol. Its IUPAC name is 2-[[(6-amino-3,5-dichloro-2-pyridinyl)amino]methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name2-[[(6-amino-3,5-dichloro-2-pyridinyl)amino]methyl]cyclohexan-1-ol
PubChem CID102758635
Molecular FormulaC12H17Cl2N3O
Molecular Weight290.19 g/mol
Exact Mass289.07
IUPAC Name2-[[(6-amino-3,5-dichloro-2-pyridinyl)amino]methyl]cyclohexan-1-ol
SMILESNc1nc(NCC2CCCCC2O)c(Cl)cc1Cl
InChIInChI=1S/C12H17Cl2N3O/c13-8-5-9(14)12(17-11(8)15)16-6-7-3-1-2-4-10(7)18/h5,7,10,18H,1-4,6H2,(H3,15,16,17)
InChIKeyXUUARSJNHOEXMG-UHFFFAOYSA-N
XLogP2.93
TPSA71.17 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.19
LogP ≤ 52.93
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 2-[[(6-amino-3,5-dichloro-2-pyridinyl)amino]methyl]cyclohexan-1-ol with MolForge

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Related Compounds

[2-[[(6-amino-3,5-dichloro-2-pyridinyl)amino]methyl]cyclopentyl]methanol
CID 102758815
[2-[[(3,5,6-trichloro-2-pyridinyl)amino]methyl]cyclohexyl]methanol
CID 102751354
2-[[(3-aminoquinoxalin-2-yl)amino]methyl]cyclohexan-1-ol
CID 102984509
2-[[(6-amino-5-chloropyrimidin-4-yl)amino]methyl]cyclopentan-1-ol
CID 106812142
3,5-dichloro-6-N-[(1-methylpiperidin-3-yl)methyl]pyridine-2,6-diamine
CID 102757522
3,5,6-trichloro-N-[(2-methylcyclohexyl)methyl]pyridin-2-amine
CID 102750821
2-[[(4,6-dichloro-1,3,5-triazin-2-yl)amino]methyl]cyclohexan-1-ol
CID 64912738
2-[[(6-amino-5-methylpyrimidin-4-yl)amino]methyl]cyclohexan-1-ol
CID 80841458
2-[[[5-chloro-2-(ethylamino)pyrimidin-4-yl]amino]methyl]cyclopentan-1-ol
CID 80856601
3,5-dichloro-6-N-ethylpyridine-2,6-diamine
CID 102755516
3,5-dichloro-2-N-ethyl-6-N-[(2-methylcyclopentyl)methyl]pyridine-2,6-diamine
CID 107421190
2-[[(2-chloro-6-methylpyrimidin-4-yl)amino]methyl]cyclohexan-1-ol
CID 64911292

Frequently Asked Questions

What is the IUPAC name of 2-[[(6-amino-3,5-dichloro-2-pyridinyl)amino]methyl]cyclohexan-1-ol?
The IUPAC name of 2-[[(6-amino-3,5-dichloro-2-pyridinyl)amino]methyl]cyclohexan-1-ol (CID 102758635) is 2-[[(6-amino-3,5-dichloro-2-pyridinyl)amino]methyl]cyclohexan-1-ol.
What is the SMILES notation for 2-[[(6-amino-3,5-dichloro-2-pyridinyl)amino]methyl]cyclohexan-1-ol?
The canonical SMILES for 2-[[(6-amino-3,5-dichloro-2-pyridinyl)amino]methyl]cyclohexan-1-ol is Nc1nc(NCC2CCCCC2O)c(Cl)cc1Cl.
What is the InChIKey of 2-[[(6-amino-3,5-dichloro-2-pyridinyl)amino]methyl]cyclohexan-1-ol?
The InChIKey is XUUARSJNHOEXMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17Cl2N3O/c13-8-5-9(14)12(17-11(8)15)16-6-7-3-1-2-4-10(7)18/h5,7,10,18H,1-4,6H2,(H3,15,16,17).
What are the key properties of 2-[[(6-amino-3,5-dichloro-2-pyridinyl)amino]methyl]cyclohexan-1-ol?
2-[[(6-amino-3,5-dichloro-2-pyridinyl)amino]methyl]cyclohexan-1-ol has a molecular weight of 290.19 g/mol, XLogP of 2.93, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(6-amino-3,5-dichloro-2-pyridinyl)amino]methyl]cyclohexan-1-ol is sourced from PubChem (CID 102758635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).