CID 59039631

C10H19N2O3 — CID 59039631

IUPAC—
SMILESCC1(C)CC(O)(C(N)=O)CC(C)(C)N1[O]
InChIInChI=1S/C10H19N2O3/c1-8(2)5-10(14,7(11)13)6-9(3,4)12(8)15/h14H,5-6H2,1-4H3,(H2,11,13)
InChIKeyGJIJFZCECLZJKP-UHFFFAOYSA-N
MW215.27 g/mol
LogP0.20
Rot. Bonds1

About CID 59039631

CID 59039631 (PubChem CID 59039631) has the molecular formula C10H19N2O3 and a molecular weight of 215.27 g/mol.

Molecular Properties

Compound NameCID 59039631
PubChem CID59039631
Molecular FormulaC10H19N2O3
Molecular Weight215.27 g/mol
Exact Mass215.14
IUPAC Name—
SMILESCC1(C)CC(O)(C(N)=O)CC(C)(C)N1[O]
InChIInChI=1S/C10H19N2O3/c1-8(2)5-10(14,7(11)13)6-9(3,4)12(8)15/h14H,5-6H2,1-4H3,(H2,11,13)
InChIKeyGJIJFZCECLZJKP-UHFFFAOYSA-N
XLogP0.20
TPSA86.46 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.27
LogP ≤ 50.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of CID 59039631?
The IUPAC name of CID 59039631 (CID 59039631) is not available.
What is the SMILES notation for CID 59039631?
The canonical SMILES for CID 59039631 is CC1(C)CC(O)(C(N)=O)CC(C)(C)N1[O].
What is the InChIKey of CID 59039631?
The InChIKey is GJIJFZCECLZJKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N2O3/c1-8(2)5-10(14,7(11)13)6-9(3,4)12(8)15/h14H,5-6H2,1-4H3,(H2,11,13).
What are the key properties of CID 59039631?
CID 59039631 has a molecular weight of 215.27 g/mol, XLogP of 0.20, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59039631 is sourced from PubChem (CID 59039631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).