CID 88764909

C4H9KNO — CID 88764909

IUPAC—
SMILESCCNC(C)=O.[K]
InChIInChI=1S/C4H9NO.K/c1-3-5-4(2)6;/h3H2,1-2H3,(H,5,6);
InChIKeyNNHKWUDRHIOMAD-UHFFFAOYSA-N
MW126.22 g/mol
LogP-0.24
Rot. Bonds1

About CID 88764909

CID 88764909 (PubChem CID 88764909) has the molecular formula C4H9KNO and a molecular weight of 126.22 g/mol.

Molecular Properties

Compound NameCID 88764909
PubChem CID88764909
Molecular FormulaC4H9KNO
Molecular Weight126.22 g/mol
Exact Mass126.03
IUPAC Name—
SMILESCCNC(C)=O.[K]
InChIInChI=1S/C4H9NO.K/c1-3-5-4(2)6;/h3H2,1-2H3,(H,5,6);
InChIKeyNNHKWUDRHIOMAD-UHFFFAOYSA-N
XLogP-0.24
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.22
LogP ≤ 5-0.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of CID 88764909?
The IUPAC name of CID 88764909 (CID 88764909) is not available.
What is the SMILES notation for CID 88764909?
The canonical SMILES for CID 88764909 is CCNC(C)=O.[K].
What is the InChIKey of CID 88764909?
The InChIKey is NNHKWUDRHIOMAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9NO.K/c1-3-5-4(2)6;/h3H2,1-2H3,(H,5,6);.
What are the key properties of CID 88764909?
CID 88764909 has a molecular weight of 126.22 g/mol, XLogP of -0.24, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 88764909 is sourced from PubChem (CID 88764909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).