2-chloro-5-(cyclopropylsulfamoylamino)phenol

C9H11ClN2O3S — CID 114809187

IUPAC2-chloro-5-(cyclopropylsulfamoylamino)phenol
SMILESO=S(=O)(Nc1ccc(Cl)c(O)c1)NC1CC1
InChIInChI=1S/C9H11ClN2O3S/c10-8-4-3-7(5-9(8)13)12-16(14,15)11-6-1-2-6/h3-6,11-13H,1-2H2
InChIKeyMBSPDBBPIQZVID-UHFFFAOYSA-N
MW262.72 g/mol
LogP1.45
Rot. Bonds4

About 2-chloro-5-(cyclopropylsulfamoylamino)phenol

2-chloro-5-(cyclopropylsulfamoylamino)phenol (PubChem CID 114809187) has the molecular formula C9H11ClN2O3S and a molecular weight of 262.72 g/mol. Its IUPAC name is 2-chloro-5-(cyclopropylsulfamoylamino)phenol.

Molecular Properties

Compound Name2-chloro-5-(cyclopropylsulfamoylamino)phenol
PubChem CID114809187
Molecular FormulaC9H11ClN2O3S
Molecular Weight262.72 g/mol
Exact Mass262.02
IUPAC Name2-chloro-5-(cyclopropylsulfamoylamino)phenol
SMILESO=S(=O)(Nc1ccc(Cl)c(O)c1)NC1CC1
InChIInChI=1S/C9H11ClN2O3S/c10-8-4-3-7(5-9(8)13)12-16(14,15)11-6-1-2-6/h3-6,11-13H,1-2H2
InChIKeyMBSPDBBPIQZVID-UHFFFAOYSA-N
XLogP1.45
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.72
LogP ≤ 51.45
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-(cyclopropylsulfamoylamino)phenol?
The IUPAC name of 2-chloro-5-(cyclopropylsulfamoylamino)phenol (CID 114809187) is 2-chloro-5-(cyclopropylsulfamoylamino)phenol.
What is the SMILES notation for 2-chloro-5-(cyclopropylsulfamoylamino)phenol?
The canonical SMILES for 2-chloro-5-(cyclopropylsulfamoylamino)phenol is O=S(=O)(Nc1ccc(Cl)c(O)c1)NC1CC1.
What is the InChIKey of 2-chloro-5-(cyclopropylsulfamoylamino)phenol?
The InChIKey is MBSPDBBPIQZVID-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11ClN2O3S/c10-8-4-3-7(5-9(8)13)12-16(14,15)11-6-1-2-6/h3-6,11-13H,1-2H2.
What are the key properties of 2-chloro-5-(cyclopropylsulfamoylamino)phenol?
2-chloro-5-(cyclopropylsulfamoylamino)phenol has a molecular weight of 262.72 g/mol, XLogP of 1.45, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-(cyclopropylsulfamoylamino)phenol is sourced from PubChem (CID 114809187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).