fluoromethane;4-propan-2-yl-2H-pyrrole

C8H14FN — CID 161177358

IUPACfluoromethane;4-propan-2-yl-2H-pyrrole
SMILESCC(C)C1=CCN=C1.CF
InChIInChI=1S/C7H11N.CH3F/c1-6(2)7-3-4-8-5-7;1-2/h3,5-6H,4H2,1-2H3;1H3
InChIKeyURZKGJIVSFFCAQ-UHFFFAOYSA-N
MW143.20 g/mol
LogP2.24
Rot. Bonds1

About fluoromethane;4-propan-2-yl-2H-pyrrole

fluoromethane;4-propan-2-yl-2H-pyrrole (PubChem CID 161177358) has the molecular formula C8H14FN and a molecular weight of 143.20 g/mol. Its IUPAC name is fluoromethane;4-propan-2-yl-2H-pyrrole.

Molecular Properties

Compound Namefluoromethane;4-propan-2-yl-2H-pyrrole
PubChem CID161177358
Molecular FormulaC8H14FN
Molecular Weight143.20 g/mol
Exact Mass143.11
IUPAC Namefluoromethane;4-propan-2-yl-2H-pyrrole
SMILESCC(C)C1=CCN=C1.CF
InChIInChI=1S/C7H11N.CH3F/c1-6(2)7-3-4-8-5-7;1-2/h3,5-6H,4H2,1-2H3;1H3
InChIKeyURZKGJIVSFFCAQ-UHFFFAOYSA-N
XLogP2.24
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.20
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-Fluoro-5-methyl-2,3-dihydropyridine
CID 68083425
(2E)-3-ethenyl-2-ethylidene-3-fluoro-N-methylpent-4-en-1-imine
CID 129196407
4-Fluoro-4-methyl-6-propan-2-yl-1,3-diazepine
CID 144503649
4-butan-2-yl-3-[(Z)-3-fluoro-2-methylbut-1-enyl]-2H-pyrrole
CID 146499188
4-tert-butyl-5-fluoro-2H-pyrrole
CID 147088160
5-fluoro-4-propan-2-yl-2H-pyrrole
CID 162095864
(E)-2-fluoro-N,3,4-trimethylpent-2-en-1-imine
CID 163527626
(Z)-2-propan-2-yl-N-(2,2,2-trifluoroethyl)but-2-en-1-imine
CID 163758951
3-fluoro-6-propan-2-yl-4H-azepine
CID 167012471
4-tert-butyl-2-(difluoromethyl)-2H-pyrrole
CID 169294432
5-Ethyl-2-fluoro-2,3-dihydropyridine
CID 169872706
(E)-2-(fluoromethyl)-N-methylpent-2-en-1-imine
CID 171493683

Frequently Asked Questions

What is the IUPAC name of fluoromethane;4-propan-2-yl-2H-pyrrole?
The IUPAC name of fluoromethane;4-propan-2-yl-2H-pyrrole (CID 161177358) is fluoromethane;4-propan-2-yl-2H-pyrrole.
What is the SMILES notation for fluoromethane;4-propan-2-yl-2H-pyrrole?
The canonical SMILES for fluoromethane;4-propan-2-yl-2H-pyrrole is CC(C)C1=CCN=C1.CF.
What is the InChIKey of fluoromethane;4-propan-2-yl-2H-pyrrole?
The InChIKey is URZKGJIVSFFCAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N.CH3F/c1-6(2)7-3-4-8-5-7;1-2/h3,5-6H,4H2,1-2H3;1H3.
What are the key properties of fluoromethane;4-propan-2-yl-2H-pyrrole?
fluoromethane;4-propan-2-yl-2H-pyrrole has a molecular weight of 143.20 g/mol, XLogP of 2.24, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for fluoromethane;4-propan-2-yl-2H-pyrrole is sourced from PubChem (CID 161177358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).