CID 59828578

C5H10NO2 — CID 59828578

IUPAC—
SMILESCOC(=O)CCC[NH]
InChIInChI=1S/C5H10NO2/c1-8-5(7)3-2-4-6/h6H,2-4H2,1H3
InChIKeyQVQDZALOIVNMRO-UHFFFAOYSA-N
MW116.14 g/mol
LogP0.22
Rot. Bonds3

About CID 59828578

CID 59828578 (PubChem CID 59828578) has the molecular formula C5H10NO2 and a molecular weight of 116.14 g/mol.

Molecular Properties

Compound NameCID 59828578
PubChem CID59828578
Molecular FormulaC5H10NO2
Molecular Weight116.14 g/mol
Exact Mass116.07
IUPAC Name—
SMILESCOC(=O)CCC[NH]
InChIInChI=1S/C5H10NO2/c1-8-5(7)3-2-4-6/h6H,2-4H2,1H3
InChIKeyQVQDZALOIVNMRO-UHFFFAOYSA-N
XLogP0.22
TPSA50.10 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500116.14
LogP ≤ 50.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of CID 59828578?
The IUPAC name of CID 59828578 (CID 59828578) is not available.
What is the SMILES notation for CID 59828578?
The canonical SMILES for CID 59828578 is COC(=O)CCC[NH].
What is the InChIKey of CID 59828578?
The InChIKey is QVQDZALOIVNMRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10NO2/c1-8-5(7)3-2-4-6/h6H,2-4H2,1H3.
What are the key properties of CID 59828578?
CID 59828578 has a molecular weight of 116.14 g/mol, XLogP of 0.22, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59828578 is sourced from PubChem (CID 59828578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).