tert-butyl N-[(2R)-3-fluoropent-3-en-2-yl]carbamate

C10H18FNO2 — CID 174109294

IUPACtert-butyl N-[(2R)-3-fluoropent-3-en-2-yl]carbamate
SMILESCC=C(F)[C@@H](C)NC(=O)OC(C)(C)C
InChIInChI=1S/C10H18FNO2/c1-6-8(11)7(2)12-9(13)14-10(3,4)5/h6-7H,1-5H3,(H,12,13)/t7-/m1/s1
InChIKeyVISJPFWBNSKLRB-SSDOTTSWSA-N
MW203.26 g/mol
LogP2.77
Rot. Bonds2

About tert-butyl N-[(2R)-3-fluoropent-3-en-2-yl]carbamate

tert-butyl N-[(2R)-3-fluoropent-3-en-2-yl]carbamate (PubChem CID 174109294) has the molecular formula C10H18FNO2 and a molecular weight of 203.26 g/mol. Its IUPAC name is tert-butyl N-[(2R)-3-fluoropent-3-en-2-yl]carbamate.

Molecular Properties

Compound Nametert-butyl N-[(2R)-3-fluoropent-3-en-2-yl]carbamate
PubChem CID174109294
Molecular FormulaC10H18FNO2
Molecular Weight203.26 g/mol
Exact Mass203.13
IUPAC Nametert-butyl N-[(2R)-3-fluoropent-3-en-2-yl]carbamate
SMILESCC=C(F)[C@@H](C)NC(=O)OC(C)(C)C
InChIInChI=1S/C10H18FNO2/c1-6-8(11)7(2)12-9(13)14-10(3,4)5/h6-7H,1-5H3,(H,12,13)/t7-/m1/s1
InChIKeyVISJPFWBNSKLRB-SSDOTTSWSA-N
XLogP2.77
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.26
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of tert-butyl N-[(2R)-3-fluoropent-3-en-2-yl]carbamate?
The IUPAC name of tert-butyl N-[(2R)-3-fluoropent-3-en-2-yl]carbamate (CID 174109294) is tert-butyl N-[(2R)-3-fluoropent-3-en-2-yl]carbamate.
What is the SMILES notation for tert-butyl N-[(2R)-3-fluoropent-3-en-2-yl]carbamate?
The canonical SMILES for tert-butyl N-[(2R)-3-fluoropent-3-en-2-yl]carbamate is CC=C(F)[C@@H](C)NC(=O)OC(C)(C)C.
What is the InChIKey of tert-butyl N-[(2R)-3-fluoropent-3-en-2-yl]carbamate?
The InChIKey is VISJPFWBNSKLRB-SSDOTTSWSA-N. The full InChI is InChI=1S/C10H18FNO2/c1-6-8(11)7(2)12-9(13)14-10(3,4)5/h6-7H,1-5H3,(H,12,13)/t7-/m1/s1.
What are the key properties of tert-butyl N-[(2R)-3-fluoropent-3-en-2-yl]carbamate?
tert-butyl N-[(2R)-3-fluoropent-3-en-2-yl]carbamate has a molecular weight of 203.26 g/mol, XLogP of 2.77, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-[(2R)-3-fluoropent-3-en-2-yl]carbamate is sourced from PubChem (CID 174109294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).