2-(2-chloroanilino)-2-cyclopropylethanol

C11H14ClNO — CID 61310756

IUPAC2-(2-chloroanilino)-2-cyclopropylethanol
SMILESOCC(Nc1ccccc1Cl)C1CC1
InChIInChI=1S/C11H14ClNO/c12-9-3-1-2-4-10(9)13-11(7-14)8-5-6-8/h1-4,8,11,13-14H,5-7H2
InChIKeyMVZRMYVGGQGIKA-UHFFFAOYSA-N
MW211.69 g/mol
LogP2.52
Rot. Bonds4

About 2-(2-chloroanilino)-2-cyclopropylethanol

2-(2-chloroanilino)-2-cyclopropylethanol (PubChem CID 61310756) has the molecular formula C11H14ClNO and a molecular weight of 211.69 g/mol. Its IUPAC name is 2-(2-chloroanilino)-2-cyclopropylethanol.

Molecular Properties

Compound Name2-(2-chloroanilino)-2-cyclopropylethanol
PubChem CID61310756
Molecular FormulaC11H14ClNO
Molecular Weight211.69 g/mol
Exact Mass211.08
IUPAC Name2-(2-chloroanilino)-2-cyclopropylethanol
SMILESOCC(Nc1ccccc1Cl)C1CC1
InChIInChI=1S/C11H14ClNO/c12-9-3-1-2-4-10(9)13-11(7-14)8-5-6-8/h1-4,8,11,13-14H,5-7H2
InChIKeyMVZRMYVGGQGIKA-UHFFFAOYSA-N
XLogP2.52
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.69
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-chloroanilino)-2-cyclopropylethanol?
The IUPAC name of 2-(2-chloroanilino)-2-cyclopropylethanol (CID 61310756) is 2-(2-chloroanilino)-2-cyclopropylethanol.
What is the SMILES notation for 2-(2-chloroanilino)-2-cyclopropylethanol?
The canonical SMILES for 2-(2-chloroanilino)-2-cyclopropylethanol is OCC(Nc1ccccc1Cl)C1CC1.
What is the InChIKey of 2-(2-chloroanilino)-2-cyclopropylethanol?
The InChIKey is MVZRMYVGGQGIKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClNO/c12-9-3-1-2-4-10(9)13-11(7-14)8-5-6-8/h1-4,8,11,13-14H,5-7H2.
What are the key properties of 2-(2-chloroanilino)-2-cyclopropylethanol?
2-(2-chloroanilino)-2-cyclopropylethanol has a molecular weight of 211.69 g/mol, XLogP of 2.52, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloroanilino)-2-cyclopropylethanol is sourced from PubChem (CID 61310756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).