1-cyclopropyl-2-(2-nitrosophenyl)ethanol

C11H13NO2 — CID 89088051

IUPAC1-cyclopropyl-2-(2-nitrosophenyl)ethanol
SMILESO=Nc1ccccc1CC(O)C1CC1
InChIInChI=1S/C11H13NO2/c13-11(8-5-6-8)7-9-3-1-2-4-10(9)12-14/h1-4,8,11,13H,5-7H2
InChIKeyDQVMQGKDCCGCKV-UHFFFAOYSA-N
MW191.23 g/mol
LogP2.40
Rot. Bonds4

About 1-cyclopropyl-2-(2-nitrosophenyl)ethanol

1-cyclopropyl-2-(2-nitrosophenyl)ethanol (PubChem CID 89088051) has the molecular formula C11H13NO2 and a molecular weight of 191.23 g/mol. Its IUPAC name is 1-cyclopropyl-2-(2-nitrosophenyl)ethanol.

Molecular Properties

Compound Name1-cyclopropyl-2-(2-nitrosophenyl)ethanol
PubChem CID89088051
Molecular FormulaC11H13NO2
Molecular Weight191.23 g/mol
Exact Mass191.09
IUPAC Name1-cyclopropyl-2-(2-nitrosophenyl)ethanol
SMILESO=Nc1ccccc1CC(O)C1CC1
InChIInChI=1S/C11H13NO2/c13-11(8-5-6-8)7-9-3-1-2-4-10(9)12-14/h1-4,8,11,13H,5-7H2
InChIKeyDQVMQGKDCCGCKV-UHFFFAOYSA-N
XLogP2.40
TPSA49.66 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.23
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-2-(2-nitrosophenyl)ethanol?
The IUPAC name of 1-cyclopropyl-2-(2-nitrosophenyl)ethanol (CID 89088051) is 1-cyclopropyl-2-(2-nitrosophenyl)ethanol.
What is the SMILES notation for 1-cyclopropyl-2-(2-nitrosophenyl)ethanol?
The canonical SMILES for 1-cyclopropyl-2-(2-nitrosophenyl)ethanol is O=Nc1ccccc1CC(O)C1CC1.
What is the InChIKey of 1-cyclopropyl-2-(2-nitrosophenyl)ethanol?
The InChIKey is DQVMQGKDCCGCKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO2/c13-11(8-5-6-8)7-9-3-1-2-4-10(9)12-14/h1-4,8,11,13H,5-7H2.
What are the key properties of 1-cyclopropyl-2-(2-nitrosophenyl)ethanol?
1-cyclopropyl-2-(2-nitrosophenyl)ethanol has a molecular weight of 191.23 g/mol, XLogP of 2.40, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-(2-nitrosophenyl)ethanol is sourced from PubChem (CID 89088051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).