2-propyl-N-(2,2,2-trifluoroethyl)pentan-1-amine

C10H20F3N — CID 82983950

IUPAC2-propyl-N-(2,2,2-trifluoroethyl)pentan-1-amine
SMILESCCCC(CCC)CNCC(F)(F)F
InChIInChI=1S/C10H20F3N/c1-3-5-9(6-4-2)7-14-8-10(11,12)13/h9,14H,3-8H2,1-2H3
InChIKeyWTTREIYLVVBJSM-UHFFFAOYSA-N
MW211.27 g/mol
LogP3.35
Rot. Bonds7

About 2-propyl-N-(2,2,2-trifluoroethyl)pentan-1-amine

2-propyl-N-(2,2,2-trifluoroethyl)pentan-1-amine (PubChem CID 82983950) has the molecular formula C10H20F3N and a molecular weight of 211.27 g/mol. Its IUPAC name is 2-propyl-N-(2,2,2-trifluoroethyl)pentan-1-amine.

Molecular Properties

Compound Name2-propyl-N-(2,2,2-trifluoroethyl)pentan-1-amine
PubChem CID82983950
Molecular FormulaC10H20F3N
Molecular Weight211.27 g/mol
Exact Mass211.15
IUPAC Name2-propyl-N-(2,2,2-trifluoroethyl)pentan-1-amine
SMILESCCCC(CCC)CNCC(F)(F)F
InChIInChI=1S/C10H20F3N/c1-3-5-9(6-4-2)7-14-8-10(11,12)13/h9,14H,3-8H2,1-2H3
InChIKeyWTTREIYLVVBJSM-UHFFFAOYSA-N
XLogP3.35
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.27
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N,2-dipropylpentan-1-amine
CID 62530512
2-(2-methylpentoxy)-N-(2,2,2-trifluoroethyl)propan-1-amine
CID 103285826
2-methyl-N-(2,2,2-trifluoroethyl)decan-1-amine
CID 114899272
2-N,2-N-dipropyl-1-N-(2,2,2-trifluoroethyl)propane-1,2-diamine
CID 62558170
N-ethyl-2,2,2-trifluoroethanamine
CID 12769779
2-(2-ethylhexoxy)-N-(2,2,2-trifluoroethyl)propan-1-amine
CID 62598118
2-(2-chloroethyl)-N-[2-(2,2,2-trifluoroethoxy)ethyl]pentan-1-amine
CID 106117233
ethane;N-ethyl-2-propylpentan-1-amine;pentane
CID 143708977
2-(2-chloroethyl)-N-(2,2-difluoroethyl)pentan-1-amine
CID 106117170
2,6-dimethyl-N-(2,2,2-trifluoroethyl)heptan-1-amine
CID 114899374
3,3-dimethyl-1-N-(2,2,2-trifluoroethyl)butane-1,2-diamine
CID 112555941
2-(4-propylpiperidin-1-yl)-N-(2,2,2-trifluoroethyl)propan-1-amine
CID 55087361

Frequently Asked Questions

What is the IUPAC name of 2-propyl-N-(2,2,2-trifluoroethyl)pentan-1-amine?
The IUPAC name of 2-propyl-N-(2,2,2-trifluoroethyl)pentan-1-amine (CID 82983950) is 2-propyl-N-(2,2,2-trifluoroethyl)pentan-1-amine.
What is the SMILES notation for 2-propyl-N-(2,2,2-trifluoroethyl)pentan-1-amine?
The canonical SMILES for 2-propyl-N-(2,2,2-trifluoroethyl)pentan-1-amine is CCCC(CCC)CNCC(F)(F)F.
What is the InChIKey of 2-propyl-N-(2,2,2-trifluoroethyl)pentan-1-amine?
The InChIKey is WTTREIYLVVBJSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20F3N/c1-3-5-9(6-4-2)7-14-8-10(11,12)13/h9,14H,3-8H2,1-2H3.
What are the key properties of 2-propyl-N-(2,2,2-trifluoroethyl)pentan-1-amine?
2-propyl-N-(2,2,2-trifluoroethyl)pentan-1-amine has a molecular weight of 211.27 g/mol, XLogP of 3.35, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propyl-N-(2,2,2-trifluoroethyl)pentan-1-amine is sourced from PubChem (CID 82983950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).