N-(2-fluoropropyl)-N,2-dimethylpropan-1-amine

C8H18FN — CID 177032219

IUPACN-(2-fluoropropyl)-N,2-dimethylpropan-1-amine
SMILESCC(C)CN(C)CC(C)F
InChIInChI=1S/C8H18FN/c1-7(2)5-10(4)6-8(3)9/h7-8H,5-6H2,1-4H3
InChIKeyYQBGVMMENDYITP-UHFFFAOYSA-N
MW147.24 g/mol
LogP1.93
Rot. Bonds4

About N-(2-fluoropropyl)-N,2-dimethylpropan-1-amine

N-(2-fluoropropyl)-N,2-dimethylpropan-1-amine (PubChem CID 177032219) has the molecular formula C8H18FN and a molecular weight of 147.24 g/mol. Its IUPAC name is N-(2-fluoropropyl)-N,2-dimethylpropan-1-amine.

Molecular Properties

Compound NameN-(2-fluoropropyl)-N,2-dimethylpropan-1-amine
PubChem CID177032219
Molecular FormulaC8H18FN
Molecular Weight147.24 g/mol
Exact Mass147.14
IUPAC NameN-(2-fluoropropyl)-N,2-dimethylpropan-1-amine
SMILESCC(C)CN(C)CC(C)F
InChIInChI=1S/C8H18FN/c1-7(2)5-10(4)6-8(3)9/h7-8H,5-6H2,1-4H3
InChIKeyYQBGVMMENDYITP-UHFFFAOYSA-N
XLogP1.93
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.24
LogP ≤ 51.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2,2-difluoroethyl)-N,2-dimethylpropan-1-amine
CID 126663851
2-fluoro-N-(iodomethyl)-N-methylpropan-1-amine
CID 170275915
ethane;N'-(2-fluoropropyl)-N'-methylmethanediamine
CID 144977225
ethane;N-ethyl-N,2-dimethylpropan-1-amine
CID 143400672
4-fluoro-N-methyl-N-(2-methylpropyl)butan-1-amine
CID 126593992
2-fluoro-N,N,4-trimethylpentan-1-amine
CID 170688420
2-[[methyl(2-methylpropyl)amino]methyl]butan-1-ol
CID 115250601
3,3,3-trifluoro-2-[[methyl(2-methylpropyl)amino]methyl]propanoic acid
CID 80996963
N-(2-fluoropropyl)-N-methylmethanesulfonamide
CID 142548580
1-cyclopropyl-2-[methyl(2-methylpropyl)amino]ethanol
CID 63906984
3-amino-4-[methyl(2-methylpropyl)amino]butan-1-ol
CID 64900718
2-N-ethyl-1-N-methyl-1-N-(2-methylpropyl)butane-1,2-diamine
CID 62040549

Frequently Asked Questions

What is the IUPAC name of N-(2-fluoropropyl)-N,2-dimethylpropan-1-amine?
The IUPAC name of N-(2-fluoropropyl)-N,2-dimethylpropan-1-amine (CID 177032219) is N-(2-fluoropropyl)-N,2-dimethylpropan-1-amine.
What is the SMILES notation for N-(2-fluoropropyl)-N,2-dimethylpropan-1-amine?
The canonical SMILES for N-(2-fluoropropyl)-N,2-dimethylpropan-1-amine is CC(C)CN(C)CC(C)F.
What is the InChIKey of N-(2-fluoropropyl)-N,2-dimethylpropan-1-amine?
The InChIKey is YQBGVMMENDYITP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18FN/c1-7(2)5-10(4)6-8(3)9/h7-8H,5-6H2,1-4H3.
What are the key properties of N-(2-fluoropropyl)-N,2-dimethylpropan-1-amine?
N-(2-fluoropropyl)-N,2-dimethylpropan-1-amine has a molecular weight of 147.24 g/mol, XLogP of 1.93, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoropropyl)-N,2-dimethylpropan-1-amine is sourced from PubChem (CID 177032219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).