CID 58221783

C8H14NO2 — CID 58221783

IUPAC—
SMILESCC(C)(C)OC(=O)N1C[CH]C1
InChIInChI=1S/C8H14NO2/c1-8(2,3)11-7(10)9-5-4-6-9/h4H,5-6H2,1-3H3
InChIKeyDVMLCIPHPVPGDR-UHFFFAOYSA-N
MW156.20 g/mol
LogP1.44
Rot. Bonds

About CID 58221783

CID 58221783 (PubChem CID 58221783) has the molecular formula C8H14NO2 and a molecular weight of 156.20 g/mol.

Molecular Properties

Compound NameCID 58221783
PubChem CID58221783
Molecular FormulaC8H14NO2
Molecular Weight156.20 g/mol
Exact Mass156.10
IUPAC Name—
SMILESCC(C)(C)OC(=O)N1C[CH]C1
InChIInChI=1S/C8H14NO2/c1-8(2,3)11-7(10)9-5-4-6-9/h4H,5-6H2,1-3H3
InChIKeyDVMLCIPHPVPGDR-UHFFFAOYSA-N
XLogP1.44
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
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

Analyze CID 58221783 with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Tert-butyl 3-iodoazetidine-1-carboxylate
CID 11000522
tert-Butyl 3-bromoazetidine-1-carboxylate
CID 53415291
3-Oxo-azetidine-1-carboxylic acid tert-butyl ester
CID 1519404
1-(tert-Butoxycarbonyl)azetidine
CID 11205910
tert-Butyl 2-oxoazetidine-1-carboxylate
CID 23179885
tert-Butyl 3-(iodomethyl)azetidine-1-carboxylate
CID 53249943
tert-Butyl 3-hydroxy-3-methylazetidine-1-carboxylate
CID 54751705
Potassium (1-(tert-butoxycarbonyl)azetidin-3-yl)trifluoroborate
CID 71696866
1-Boc-3-fluoro-3-methylazetidine
CID 55271007
tert-Butyl 3-ethynylazetidine-1-carboxylate
CID 54349237
tert-Butyl 3-cyano-3-methylazetidine-1-carboxylate
CID 56971684
tert-Butyl 3-sulfanylazetidine-1-carboxylate
CID 58513580

Frequently Asked Questions

What is the IUPAC name of CID 58221783?
The IUPAC name of CID 58221783 (CID 58221783) is not available.
What is the SMILES notation for CID 58221783?
The canonical SMILES for CID 58221783 is CC(C)(C)OC(=O)N1C[CH]C1.
What is the InChIKey of CID 58221783?
The InChIKey is DVMLCIPHPVPGDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14NO2/c1-8(2,3)11-7(10)9-5-4-6-9/h4H,5-6H2,1-3H3.
What are the key properties of CID 58221783?
CID 58221783 has a molecular weight of 156.20 g/mol, XLogP of 1.44, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 58221783 is sourced from PubChem (CID 58221783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).