CID 59694522

C12H19NO — CID 59694522

IUPAC—
SMILES[CH]C1CCN(C(=O)C2CCCCC2)C1
InChIInChI=1S/C12H19NO/c1-10-7-8-13(9-10)12(14)11-5-3-2-4-6-11/h1,10-11H,2-9H2
InChIKeyCVMDGYHYJYSJEH-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.13
Rot. Bonds1

About CID 59694522

CID 59694522 (PubChem CID 59694522) has the molecular formula C12H19NO and a molecular weight of 193.29 g/mol.

Molecular Properties

Compound NameCID 59694522
PubChem CID59694522
Molecular FormulaC12H19NO
Molecular Weight193.29 g/mol
Exact Mass193.15
IUPAC Name—
SMILES[CH]C1CCN(C(=O)C2CCCCC2)C1
InChIInChI=1S/C12H19NO/c1-10-7-8-13(9-10)12(14)11-5-3-2-4-6-11/h1,10-11H,2-9H2
InChIKeyCVMDGYHYJYSJEH-UHFFFAOYSA-N
XLogP2.13
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of CID 59694522?
The IUPAC name of CID 59694522 (CID 59694522) is not available.
What is the SMILES notation for CID 59694522?
The canonical SMILES for CID 59694522 is [CH]C1CCN(C(=O)C2CCCCC2)C1.
What is the InChIKey of CID 59694522?
The InChIKey is CVMDGYHYJYSJEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO/c1-10-7-8-13(9-10)12(14)11-5-3-2-4-6-11/h1,10-11H,2-9H2.
What are the key properties of CID 59694522?
CID 59694522 has a molecular weight of 193.29 g/mol, XLogP of 2.13, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59694522 is sourced from PubChem (CID 59694522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).