CID 70188356

C11H12KN2O2 — CID 70188356

IUPAC—
SMILESN[C@@H](Cc1c[nH]c2ccccc12)C(=O)O.[K]
InChIInChI=1S/C11H12N2O2.K/c12-9(11(14)15)5-7-6-13-10-4-2-1-3-8(7)10;/h1-4,6,9,13H,5,12H2,(H,14,15);/t9-;/m0./s1
InChIKeyNVYYCEJEZNUDSZ-FVGYRXGTSA-N
MW243.33 g/mol
LogP0.74
Rot. Bonds3

About CID 70188356

CID 70188356 (PubChem CID 70188356) has the molecular formula C11H12KN2O2 and a molecular weight of 243.33 g/mol.

Molecular Properties

Compound NameCID 70188356
PubChem CID70188356
Molecular FormulaC11H12KN2O2
Molecular Weight243.33 g/mol
Exact Mass243.05
IUPAC Name—
SMILESN[C@@H](Cc1c[nH]c2ccccc12)C(=O)O.[K]
InChIInChI=1S/C11H12N2O2.K/c12-9(11(14)15)5-7-6-13-10-4-2-1-3-8(7)10;/h1-4,6,9,13H,5,12H2,(H,14,15);/t9-;/m0./s1
InChIKeyNVYYCEJEZNUDSZ-FVGYRXGTSA-N
XLogP0.74
TPSA79.11 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.33
LogP ≤ 50.74
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of CID 70188356?
The IUPAC name of CID 70188356 (CID 70188356) is not available.
What is the SMILES notation for CID 70188356?
The canonical SMILES for CID 70188356 is N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O.[K].
What is the InChIKey of CID 70188356?
The InChIKey is NVYYCEJEZNUDSZ-FVGYRXGTSA-N. The full InChI is InChI=1S/C11H12N2O2.K/c12-9(11(14)15)5-7-6-13-10-4-2-1-3-8(7)10;/h1-4,6,9,13H,5,12H2,(H,14,15);/t9-;/m0./s1.
What are the key properties of CID 70188356?
CID 70188356 has a molecular weight of 243.33 g/mol, XLogP of 0.74, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 70188356 is sourced from PubChem (CID 70188356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).