CID 57427535

C8H14NO2 — CID 57427535

IUPAC—
SMILESCCOC(=O)N1CC[CH]CC1
InChIInChI=1S/C8H14NO2/c1-2-11-8(10)9-6-4-3-5-7-9/h3H,2,4-7H2,1H3
InChIKeyNWWLVEDANGANEY-UHFFFAOYSA-N
MW156.20 g/mol
LogP1.44
Rot. Bonds1

About CID 57427535

CID 57427535 (PubChem CID 57427535) has the molecular formula C8H14NO2 and a molecular weight of 156.20 g/mol.

Molecular Properties

Compound NameCID 57427535
PubChem CID57427535
Molecular FormulaC8H14NO2
Molecular Weight156.20 g/mol
Exact Mass156.10
IUPAC Name—
SMILESCCOC(=O)N1CC[CH]CC1
InChIInChI=1S/C8H14NO2/c1-2-11-8(10)9-6-4-3-5-7-9/h3H,2,4-7H2,1H3
InChIKeyNWWLVEDANGANEY-UHFFFAOYSA-N
XLogP1.44
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.20
LogP ≤ 51.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of CID 57427535?
The IUPAC name of CID 57427535 (CID 57427535) is not available.
What is the SMILES notation for CID 57427535?
The canonical SMILES for CID 57427535 is CCOC(=O)N1CC[CH]CC1.
What is the InChIKey of CID 57427535?
The InChIKey is NWWLVEDANGANEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14NO2/c1-2-11-8(10)9-6-4-3-5-7-9/h3H,2,4-7H2,1H3.
What are the key properties of CID 57427535?
CID 57427535 has a molecular weight of 156.20 g/mol, XLogP of 1.44, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 57427535 is sourced from PubChem (CID 57427535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).