N-cyclopropyl-4-hydroxy-N,2-dimethylbenzamide

C12H15NO2 — CID 103863729

IUPACN-cyclopropyl-4-hydroxy-N,2-dimethylbenzamide
SMILESCc1cc(O)ccc1C(=O)N(C)C1CC1
InChIInChI=1S/C12H15NO2/c1-8-7-10(14)5-6-11(8)12(15)13(2)9-3-4-9/h5-7,9,14H,3-4H2,1-2H3
InChIKeyCDSPQCNAAUFDOX-UHFFFAOYSA-N
MW205.26 g/mol
LogP1.94
Rot. Bonds2

About N-cyclopropyl-4-hydroxy-N,2-dimethylbenzamide

N-cyclopropyl-4-hydroxy-N,2-dimethylbenzamide (PubChem CID 103863729) has the molecular formula C12H15NO2 and a molecular weight of 205.26 g/mol. Its IUPAC name is N-cyclopropyl-4-hydroxy-N,2-dimethylbenzamide.

Molecular Properties

Compound NameN-cyclopropyl-4-hydroxy-N,2-dimethylbenzamide
PubChem CID103863729
Molecular FormulaC12H15NO2
Molecular Weight205.26 g/mol
Exact Mass205.11
IUPAC NameN-cyclopropyl-4-hydroxy-N,2-dimethylbenzamide
SMILESCc1cc(O)ccc1C(=O)N(C)C1CC1
InChIInChI=1S/C12H15NO2/c1-8-7-10(14)5-6-11(8)12(15)13(2)9-3-4-9/h5-7,9,14H,3-4H2,1-2H3
InChIKeyCDSPQCNAAUFDOX-UHFFFAOYSA-N
XLogP1.94
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-hydroxy-N,2-dimethylbenzamide?
The IUPAC name of N-cyclopropyl-4-hydroxy-N,2-dimethylbenzamide (CID 103863729) is N-cyclopropyl-4-hydroxy-N,2-dimethylbenzamide.
What is the SMILES notation for N-cyclopropyl-4-hydroxy-N,2-dimethylbenzamide?
The canonical SMILES for N-cyclopropyl-4-hydroxy-N,2-dimethylbenzamide is Cc1cc(O)ccc1C(=O)N(C)C1CC1.
What is the InChIKey of N-cyclopropyl-4-hydroxy-N,2-dimethylbenzamide?
The InChIKey is CDSPQCNAAUFDOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO2/c1-8-7-10(14)5-6-11(8)12(15)13(2)9-3-4-9/h5-7,9,14H,3-4H2,1-2H3.
What are the key properties of N-cyclopropyl-4-hydroxy-N,2-dimethylbenzamide?
N-cyclopropyl-4-hydroxy-N,2-dimethylbenzamide has a molecular weight of 205.26 g/mol, XLogP of 1.94, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-hydroxy-N,2-dimethylbenzamide is sourced from PubChem (CID 103863729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).