fluoroethane;N-methylpropan-1-amine

C6H16FN — CID 142447167

IUPACfluoroethane;N-methylpropan-1-amine
SMILESCCCNC.CCF
InChIInChI=1S/C4H11N.C2H5F/c1-3-4-5-2;1-2-3/h5H,3-4H2,1-2H3;2H2,1H3
InChIKeyIDMLSHUHKIPFJI-UHFFFAOYSA-N
MW121.20 g/mol
LogP1.59
Rot. Bonds2

About fluoroethane;N-methylpropan-1-amine

fluoroethane;N-methylpropan-1-amine (PubChem CID 142447167) has the molecular formula C6H16FN and a molecular weight of 121.20 g/mol. Its IUPAC name is fluoroethane;N-methylpropan-1-amine.

Molecular Properties

Compound Namefluoroethane;N-methylpropan-1-amine
PubChem CID142447167
Molecular FormulaC6H16FN
Molecular Weight121.20 g/mol
Exact Mass121.13
IUPAC Namefluoroethane;N-methylpropan-1-amine
SMILESCCCNC.CCF
InChIInChI=1S/C4H11N.C2H5F/c1-3-4-5-2;1-2-3/h5H,3-4H2,1-2H3;2H2,1H3
InChIKeyIDMLSHUHKIPFJI-UHFFFAOYSA-N
XLogP1.59
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500121.20
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze fluoroethane;N-methylpropan-1-amine 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

ethene;N-methylethanamine;N-methylpropan-1-amine
CID 143374724
ethane;N-fluoro-N-methylethanamine;N-methylpropan-1-amine
CID 176946215
N-methylpropan-1-amine;sulfuric acid
CID 159819552
2,3-dimethylpentane;N-methylpropan-1-amine
CID 162382755
N-methylbutan-1-amine
CID 8068
N-methylpropan-1-amine;pentanal
CID 145316342
butane;fluoroethane;propane
CID 171505953
N,N'-dimethylethane-1,2-diamine;ethane
CID 90689080
ethane;N-methylbutan-1-amine;propane
CID 142092371
N-methyltriacontan-1-amine
CID 19840895
fluoroethane;trihydrochloride
CID 172790972
ethane;N-methylbutan-1-amine;N-methylethanamine
CID 162138927

Frequently Asked Questions

What is the IUPAC name of fluoroethane;N-methylpropan-1-amine?
The IUPAC name of fluoroethane;N-methylpropan-1-amine (CID 142447167) is fluoroethane;N-methylpropan-1-amine.
What is the SMILES notation for fluoroethane;N-methylpropan-1-amine?
The canonical SMILES for fluoroethane;N-methylpropan-1-amine is CCCNC.CCF.
What is the InChIKey of fluoroethane;N-methylpropan-1-amine?
The InChIKey is IDMLSHUHKIPFJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11N.C2H5F/c1-3-4-5-2;1-2-3/h5H,3-4H2,1-2H3;2H2,1H3.
What are the key properties of fluoroethane;N-methylpropan-1-amine?
fluoroethane;N-methylpropan-1-amine has a molecular weight of 121.20 g/mol, XLogP of 1.59, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for fluoroethane;N-methylpropan-1-amine is sourced from PubChem (CID 142447167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).