CID 58998185

C10H19NO — CID 58998185

IUPAC—
SMILES[CH]C(CC)(CC)N1CCOCC1
InChIInChI=1S/C10H19NO/c1-4-10(3,5-2)11-6-8-12-9-7-11/h3H,4-9H2,1-2H3
InChIKeySPDOZBFEFOZXKU-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.59
Rot. Bonds3

About CID 58998185

CID 58998185 (PubChem CID 58998185) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol.

Molecular Properties

Compound NameCID 58998185
PubChem CID58998185
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name—
SMILES[CH]C(CC)(CC)N1CCOCC1
InChIInChI=1S/C10H19NO/c1-4-10(3,5-2)11-6-8-12-9-7-11/h3H,4-9H2,1-2H3
InChIKeySPDOZBFEFOZXKU-UHFFFAOYSA-N
XLogP1.59
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of CID 58998185?
The IUPAC name of CID 58998185 (CID 58998185) is not available.
What is the SMILES notation for CID 58998185?
The canonical SMILES for CID 58998185 is [CH]C(CC)(CC)N1CCOCC1.
What is the InChIKey of CID 58998185?
The InChIKey is SPDOZBFEFOZXKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-4-10(3,5-2)11-6-8-12-9-7-11/h3H,4-9H2,1-2H3.
What are the key properties of CID 58998185?
CID 58998185 has a molecular weight of 169.27 g/mol, XLogP of 1.59, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 58998185 is sourced from PubChem (CID 58998185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).