2-[(6-chloro-3-pyridinyl)amino]ethanol

C7H9ClN2O — CID 118956304

IUPAC2-[(6-chloro-3-pyridinyl)amino]ethanol
SMILESOCCNc1ccc(Cl)nc1
InChIInChI=1S/C7H9ClN2O/c8-7-2-1-6(5-10-7)9-3-4-11/h1-2,5,9,11H,3-4H2
InChIKeyLTHAOLKGYRUOIB-UHFFFAOYSA-N
MW172.62 g/mol
LogP1.14
Rot. Bonds3

About 2-[(6-chloro-3-pyridinyl)amino]ethanol

2-[(6-chloro-3-pyridinyl)amino]ethanol (PubChem CID 118956304) has the molecular formula C7H9ClN2O and a molecular weight of 172.62 g/mol. Its IUPAC name is 2-[(6-chloro-3-pyridinyl)amino]ethanol.

Molecular Properties

Compound Name2-[(6-chloro-3-pyridinyl)amino]ethanol
PubChem CID118956304
Molecular FormulaC7H9ClN2O
Molecular Weight172.62 g/mol
Exact Mass172.04
IUPAC Name2-[(6-chloro-3-pyridinyl)amino]ethanol
SMILESOCCNc1ccc(Cl)nc1
InChIInChI=1S/C7H9ClN2O/c8-7-2-1-6(5-10-7)9-3-4-11/h1-2,5,9,11H,3-4H2
InChIKeyLTHAOLKGYRUOIB-UHFFFAOYSA-N
XLogP1.14
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.62
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

[(6-chloro-3-pyridinyl)amino]methanethiol
CID 88611899
tert-butyl N-[2-[(6-chloro-3-pyridinyl)amino]ethyl]carbamate
CID 112639562
5-(2-hydroxyethylamino)pyridine-2-carbaldehyde
CID 167016438
6-chloro-N-[2-[1-(dimethylamino)cyclopropyl]ethyl]pyridin-3-amine
CID 90735208
6-chloro-N-(2-hydroxyethyl)pyridine-3-sulfonamide
CID 4862052
6-chloro-N-trimethylsilylpyridin-3-amine
CID 134860798
6-chloro-N-prop-1-en-2-ylpyridin-3-amine
CID 89013102
tert-butyl N-tert-butyl-N-[2-[(6-chloro-3-pyridinyl)amino]ethyl]carbamate
CID 107445970
6-chloro-N-[(5-chloro-1,3-thiazol-2-yl)methyl]pyridin-3-amine
CID 104877929
2-(4-amino-3-chloroanilino)ethanol
CID 54315994
6-chloro-N-phenylpyridin-3-amine
CID 175055218
2-anilino-N-(6-chloro-3-pyridinyl)acetamide
CID 81489216

Frequently Asked Questions

What is the IUPAC name of 2-[(6-chloro-3-pyridinyl)amino]ethanol?
The IUPAC name of 2-[(6-chloro-3-pyridinyl)amino]ethanol (CID 118956304) is 2-[(6-chloro-3-pyridinyl)amino]ethanol.
What is the SMILES notation for 2-[(6-chloro-3-pyridinyl)amino]ethanol?
The canonical SMILES for 2-[(6-chloro-3-pyridinyl)amino]ethanol is OCCNc1ccc(Cl)nc1.
What is the InChIKey of 2-[(6-chloro-3-pyridinyl)amino]ethanol?
The InChIKey is LTHAOLKGYRUOIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9ClN2O/c8-7-2-1-6(5-10-7)9-3-4-11/h1-2,5,9,11H,3-4H2.
What are the key properties of 2-[(6-chloro-3-pyridinyl)amino]ethanol?
2-[(6-chloro-3-pyridinyl)amino]ethanol has a molecular weight of 172.62 g/mol, XLogP of 1.14, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-chloro-3-pyridinyl)amino]ethanol is sourced from PubChem (CID 118956304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).