2-[(4-chloro-2-pyridinyl)amino]phenol

C11H9ClN2O — CID 175357814

IUPAC2-[(4-chloro-2-pyridinyl)amino]phenol
SMILESOc1ccccc1Nc1cc(Cl)ccn1
InChIInChI=1S/C11H9ClN2O/c12-8-5-6-13-11(7-8)14-9-3-1-2-4-10(9)15/h1-7,15H,(H,13,14)
InChIKeyUGHMWIDQDNPPIX-UHFFFAOYSA-N
MW220.66 g/mol
LogP3.18
Rot. Bonds2

About 2-[(4-chloro-2-pyridinyl)amino]phenol

2-[(4-chloro-2-pyridinyl)amino]phenol (PubChem CID 175357814) has the molecular formula C11H9ClN2O and a molecular weight of 220.66 g/mol. Its IUPAC name is 2-[(4-chloro-2-pyridinyl)amino]phenol.

Molecular Properties

Compound Name2-[(4-chloro-2-pyridinyl)amino]phenol
PubChem CID175357814
Molecular FormulaC11H9ClN2O
Molecular Weight220.66 g/mol
Exact Mass220.04
IUPAC Name2-[(4-chloro-2-pyridinyl)amino]phenol
SMILESOc1ccccc1Nc1cc(Cl)ccn1
InChIInChI=1S/C11H9ClN2O/c12-8-5-6-13-11(7-8)14-9-3-1-2-4-10(9)15/h1-7,15H,(H,13,14)
InChIKeyUGHMWIDQDNPPIX-UHFFFAOYSA-N
XLogP3.18
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.66
LogP ≤ 53.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(4-chloro-2-pyridinyl)pyrimidin-2-amine
CID 118249159
4-chloro-N-(2-hydroxyphenyl)pyridine-2-carboxamide
CID 35852171
N-(4-chloro-2-pyridinyl)-3-hydroxypyridine-2-carboxamide
CID 104820977
1-(4-chloro-2-pyridinyl)-3-pyridin-2-ylurea
CID 108894678
(4-chloro-2-pyridinyl)hydrazine;hydrochloride
CID 134830338
4-chloro-N-[2-[(4-chloropyridine-2-carbonyl)amino]phenyl]pyridine-2-carboxamide
CID 102274363
2-[2-(2-hydroxyanilino)anilino]phenol
CID 19351988
N-(4-chloro-2-pyridinyl)-2-hydroxyacetamide
CID 83768276
4-N,6-N-bis(2-chlorophenyl)pyrimidine-4,6-diamine
CID 112865738
2-amino-N-(4-chloro-2-pyridinyl)benzamide
CID 103950182
N-(4-chloro-2-pyridinyl)-2-methoxypyrimidin-4-amine
CID 118238004
3-chloro-N-(4-chloro-2-pyridinyl)benzamide
CID 3011465

Frequently Asked Questions

What is the IUPAC name of 2-[(4-chloro-2-pyridinyl)amino]phenol?
The IUPAC name of 2-[(4-chloro-2-pyridinyl)amino]phenol (CID 175357814) is 2-[(4-chloro-2-pyridinyl)amino]phenol.
What is the SMILES notation for 2-[(4-chloro-2-pyridinyl)amino]phenol?
The canonical SMILES for 2-[(4-chloro-2-pyridinyl)amino]phenol is Oc1ccccc1Nc1cc(Cl)ccn1.
What is the InChIKey of 2-[(4-chloro-2-pyridinyl)amino]phenol?
The InChIKey is UGHMWIDQDNPPIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9ClN2O/c12-8-5-6-13-11(7-8)14-9-3-1-2-4-10(9)15/h1-7,15H,(H,13,14).
What are the key properties of 2-[(4-chloro-2-pyridinyl)amino]phenol?
2-[(4-chloro-2-pyridinyl)amino]phenol has a molecular weight of 220.66 g/mol, XLogP of 3.18, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-chloro-2-pyridinyl)amino]phenol is sourced from PubChem (CID 175357814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).