CID 58122074

C10H19NO — CID 58122074

IUPAC—
SMILES[CH]C(C)(C)CNC(=O)C(C)CC
InChIInChI=1S/C10H19NO/c1-6-8(2)9(12)11-7-10(3,4)5/h3,8H,6-7H2,1-2,4-5H3,(H,11,12)
InChIKeyMELGQLSXZKRBFQ-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.89
Rot. Bonds4

About CID 58122074

CID 58122074 (PubChem CID 58122074) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol.

Molecular Properties

Compound NameCID 58122074
PubChem CID58122074
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name—
SMILES[CH]C(C)(C)CNC(=O)C(C)CC
InChIInChI=1S/C10H19NO/c1-6-8(2)9(12)11-7-10(3,4)5/h3,8H,6-7H2,1-2,4-5H3,(H,11,12)
InChIKeyMELGQLSXZKRBFQ-UHFFFAOYSA-N
XLogP1.89
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of CID 58122074?
The IUPAC name of CID 58122074 (CID 58122074) is not available.
What is the SMILES notation for CID 58122074?
The canonical SMILES for CID 58122074 is [CH]C(C)(C)CNC(=O)C(C)CC.
What is the InChIKey of CID 58122074?
The InChIKey is MELGQLSXZKRBFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-6-8(2)9(12)11-7-10(3,4)5/h3,8H,6-7H2,1-2,4-5H3,(H,11,12).
What are the key properties of CID 58122074?
CID 58122074 has a molecular weight of 169.27 g/mol, XLogP of 1.89, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 58122074 is sourced from PubChem (CID 58122074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).