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

C11H16Cl2N2O — CID 107849091

IUPAC6-[(3,5-dichloro-2-pyridinyl)amino]hexan-1-ol
SMILESOCCCCCCNc1ncc(Cl)cc1Cl
InChIInChI=1S/C11H16Cl2N2O/c12-9-7-10(13)11(15-8-9)14-5-3-1-2-4-6-16/h7-8,16H,1-6H2,(H,14,15)
InChIKeyTZLLPSUHJGTNIJ-UHFFFAOYSA-N
MW263.17 g/mol
LogP3.35
Rot. Bonds7

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

6-[(3,5-dichloro-2-pyridinyl)amino]hexan-1-ol (PubChem CID 107849091) has the molecular formula C11H16Cl2N2O and a molecular weight of 263.17 g/mol. Its IUPAC name is 6-[(3,5-dichloro-2-pyridinyl)amino]hexan-1-ol.

Molecular Properties

Compound Name6-[(3,5-dichloro-2-pyridinyl)amino]hexan-1-ol
PubChem CID107849091
Molecular FormulaC11H16Cl2N2O
Molecular Weight263.17 g/mol
Exact Mass262.06
IUPAC Name6-[(3,5-dichloro-2-pyridinyl)amino]hexan-1-ol
SMILESOCCCCCCNc1ncc(Cl)cc1Cl
InChIInChI=1S/C11H16Cl2N2O/c12-9-7-10(13)11(15-8-9)14-5-3-1-2-4-6-16/h7-8,16H,1-6H2,(H,14,15)
InChIKeyTZLLPSUHJGTNIJ-UHFFFAOYSA-N
XLogP3.35
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.17
LogP ≤ 53.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-[(3-amino-5-chloro-2-pyridinyl)amino]butan-1-ol
CID 106840375
N'-(3,5-dichloro-2-pyridinyl)propane-1,3-diamine
CID 14397361
4-[(5-chloro-3-nitro-2-pyridinyl)amino]butan-1-ol
CID 106842697
3,5-dichloro-N-propylpyridin-2-amine
CID 30058037
3,5-dichloro-N-(4-propan-2-yloxybutyl)pyridin-2-amine
CID 114137188
4-[(6-amino-3,5-dichloro-2-pyridinyl)amino]butan-1-ol
CID 106847028
6-[[5-chloro-2-(ethylamino)pyrimidin-4-yl]amino]hexan-1-ol
CID 107855284
5-[(5-chloro-2-methoxypyrimidin-4-yl)amino]pentan-1-ol
CID 107302432
N-[2-(2-aminoethoxy)ethyl]-3,5-dichloropyridin-2-amine
CID 63766858
5-(3,5-dichloroanilino)pentan-1-ol
CID 62227515
tert-butyl N-[2-[(3,5-dichloro-2-pyridinyl)amino]ethyl]carbamate
CID 115697235
6-(3,4-dichloroanilino)hexan-1-ol
CID 103801947

Frequently Asked Questions

What is the IUPAC name of 6-[(3,5-dichloro-2-pyridinyl)amino]hexan-1-ol?
The IUPAC name of 6-[(3,5-dichloro-2-pyridinyl)amino]hexan-1-ol (CID 107849091) is 6-[(3,5-dichloro-2-pyridinyl)amino]hexan-1-ol.
What is the SMILES notation for 6-[(3,5-dichloro-2-pyridinyl)amino]hexan-1-ol?
The canonical SMILES for 6-[(3,5-dichloro-2-pyridinyl)amino]hexan-1-ol is OCCCCCCNc1ncc(Cl)cc1Cl.
What is the InChIKey of 6-[(3,5-dichloro-2-pyridinyl)amino]hexan-1-ol?
The InChIKey is TZLLPSUHJGTNIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16Cl2N2O/c12-9-7-10(13)11(15-8-9)14-5-3-1-2-4-6-16/h7-8,16H,1-6H2,(H,14,15).
What are the key properties of 6-[(3,5-dichloro-2-pyridinyl)amino]hexan-1-ol?
6-[(3,5-dichloro-2-pyridinyl)amino]hexan-1-ol has a molecular weight of 263.17 g/mol, XLogP of 3.35, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(3,5-dichloro-2-pyridinyl)amino]hexan-1-ol is sourced from PubChem (CID 107849091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).