CID 67328781

C5H10NO2P — CID 67328781

IUPAC—
SMILESO=P(=O)N1CCCCC1
InChIInChI=1S/C5H10NO2P/c7-9(8)6-4-2-1-3-5-6/h1-5H2
InChIKeyGPZQWCMHMYPBPH-UHFFFAOYSA-N
MW147.11 g/mol
LogP1.56
Rot. Bonds1

About CID 67328781

CID 67328781 (PubChem CID 67328781) has the molecular formula C5H10NO2P and a molecular weight of 147.11 g/mol.

Molecular Properties

Compound NameCID 67328781
PubChem CID67328781
Molecular FormulaC5H10NO2P
Molecular Weight147.11 g/mol
Exact Mass147.04
IUPAC Name—
SMILESO=P(=O)N1CCCCC1
InChIInChI=1S/C5H10NO2P/c7-9(8)6-4-2-1-3-5-6/h1-5H2
InChIKeyGPZQWCMHMYPBPH-UHFFFAOYSA-N
XLogP1.56
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.11
LogP ≤ 51.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of CID 67328781?
The IUPAC name of CID 67328781 (CID 67328781) is not available.
What is the SMILES notation for CID 67328781?
The canonical SMILES for CID 67328781 is O=P(=O)N1CCCCC1.
What is the InChIKey of CID 67328781?
The InChIKey is GPZQWCMHMYPBPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10NO2P/c7-9(8)6-4-2-1-3-5-6/h1-5H2.
What are the key properties of CID 67328781?
CID 67328781 has a molecular weight of 147.11 g/mol, XLogP of 1.56, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 67328781 is sourced from PubChem (CID 67328781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).