2-Chlorophenol;piperazine

C10H15ClN2O — CID 157300596

IUPAC2-chlorophenol;piperazine
SMILESC1CNCCN1.C1=CC=C(C(=C1)O)Cl
InChIInChI=1S/C6H5ClO.C4H10N2/c7-5-3-1-2-4-6(5)8;1-2-6-4-3-5-1/h1-4,8H;5-6H,1-4H2
InChIKeyBBVXCTMITMQVAX-UHFFFAOYSA-N
MW214.69 g/mol
LogP—
Rot. Bonds

About 2-Chlorophenol;piperazine

2-Chlorophenol;piperazine (PubChem CID 157300596) has the molecular formula C10H15ClN2O and a molecular weight of 214.69 g/mol. Its IUPAC name is 2-chlorophenol;piperazine.

Molecular Properties

Compound Name2-Chlorophenol;piperazine
PubChem CID157300596
Molecular FormulaC10H15ClN2O
Molecular Weight214.69 g/mol
Exact Mass214.09
IUPAC Name2-chlorophenol;piperazine
SMILESC1CNCCN1.C1=CC=C(C(=C1)O)Cl
InChIInChI=1S/C6H5ClO.C4H10N2/c7-5-3-1-2-4-6(5)8;1-2-6-4-3-5-1/h1-4,8H;5-6H,1-4H2
InChIKeyBBVXCTMITMQVAX-UHFFFAOYSA-N
XLogP—
TPSA44.30 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity101

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.69
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-Chlorophenol;piperazine?
The IUPAC name of 2-Chlorophenol;piperazine (CID 157300596) is 2-chlorophenol;piperazine.
What is the SMILES notation for 2-Chlorophenol;piperazine?
The canonical SMILES for 2-Chlorophenol;piperazine is C1CNCCN1.C1=CC=C(C(=C1)O)Cl.
What is the InChIKey of 2-Chlorophenol;piperazine?
The InChIKey is BBVXCTMITMQVAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5ClO.C4H10N2/c7-5-3-1-2-4-6(5)8;1-2-6-4-3-5-1/h1-4,8H;5-6H,1-4H2.
What are the key properties of 2-Chlorophenol;piperazine?
2-Chlorophenol;piperazine has a molecular weight of 214.69 g/mol, XLogP of not available, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-Chlorophenol;piperazine is sourced from PubChem (CID 157300596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).