N-ethyl-4-(2,2,3,3-tetrafluoropropoxy)pentan-1-amine

C10H19F4NO — CID 62455814

IUPACN-ethyl-4-(2,2,3,3-tetrafluoropropoxy)pentan-1-amine
SMILESCCNCCCC(C)OCC(F)(F)C(F)F
InChIInChI=1S/C10H19F4NO/c1-3-15-6-4-5-8(2)16-7-10(13,14)9(11)12/h8-9,15H,3-7H2,1-2H3
InChIKeyGNHXCWXLZKNFDL-UHFFFAOYSA-N
MW245.26 g/mol
LogP2.68
Rot. Bonds9

About N-ethyl-4-(2,2,3,3-tetrafluoropropoxy)pentan-1-amine

N-ethyl-4-(2,2,3,3-tetrafluoropropoxy)pentan-1-amine (PubChem CID 62455814) has the molecular formula C10H19F4NO and a molecular weight of 245.26 g/mol. Its IUPAC name is N-ethyl-4-(2,2,3,3-tetrafluoropropoxy)pentan-1-amine.

Molecular Properties

Compound NameN-ethyl-4-(2,2,3,3-tetrafluoropropoxy)pentan-1-amine
PubChem CID62455814
Molecular FormulaC10H19F4NO
Molecular Weight245.26 g/mol
Exact Mass245.14
IUPAC NameN-ethyl-4-(2,2,3,3-tetrafluoropropoxy)pentan-1-amine
SMILESCCNCCCC(C)OCC(F)(F)C(F)F
InChIInChI=1S/C10H19F4NO/c1-3-15-6-4-5-8(2)16-7-10(13,14)9(11)12/h8-9,15H,3-7H2,1-2H3
InChIKeyGNHXCWXLZKNFDL-UHFFFAOYSA-N
XLogP2.68
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.26
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Related Compounds

4-(4,4,4-Trifluorobutoxy)piperidine
CID 115514539
N-methyl-3-(4,4,4-trifluorobutoxy)pentan-1-amine
CID 142009793
1,1,1,3,3,3-Hexafluoro-2-methoxypropane;piperidine
CID 143759756
2,2,2-trifluoro-N-[2-(3-propyloxiran-2-yl)ethyl]ethanamine
CID 162548883
3,3-difluoro-N-methyl-5-propan-2-yloxypentan-1-amine
CID 167254115
N-[(2S)-butan-2-yl]-3,3-difluoro-5-propan-2-yloxypentan-1-amine
CID 173769374
N-[4-(2,2,3,3-tetrafluoropropoxy)pentyl]cyclopropanamine
CID 55077605
N-ethyl-5-(2,2,2-trifluoroethoxy)pentan-2-amine
CID 61490701
N-propyl-5-(2,2,2-trifluoroethoxy)pentan-2-amine
CID 61490702
N-[3-(2,2,2-trifluoroethoxy)propyl]pentan-1-amine
CID 61491263
N-ethyl-5-(2,2,2-trifluoroethoxy)pentan-1-amine
CID 62443684
N-propyl-5-(2,2,2-trifluoroethoxy)pentan-1-amine
CID 62443685

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-(2,2,3,3-tetrafluoropropoxy)pentan-1-amine?
The IUPAC name of N-ethyl-4-(2,2,3,3-tetrafluoropropoxy)pentan-1-amine (CID 62455814) is N-ethyl-4-(2,2,3,3-tetrafluoropropoxy)pentan-1-amine.
What is the SMILES notation for N-ethyl-4-(2,2,3,3-tetrafluoropropoxy)pentan-1-amine?
The canonical SMILES for N-ethyl-4-(2,2,3,3-tetrafluoropropoxy)pentan-1-amine is CCNCCCC(C)OCC(F)(F)C(F)F.
What is the InChIKey of N-ethyl-4-(2,2,3,3-tetrafluoropropoxy)pentan-1-amine?
The InChIKey is GNHXCWXLZKNFDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19F4NO/c1-3-15-6-4-5-8(2)16-7-10(13,14)9(11)12/h8-9,15H,3-7H2,1-2H3.
What are the key properties of N-ethyl-4-(2,2,3,3-tetrafluoropropoxy)pentan-1-amine?
N-ethyl-4-(2,2,3,3-tetrafluoropropoxy)pentan-1-amine has a molecular weight of 245.26 g/mol, XLogP of 2.68, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-(2,2,3,3-tetrafluoropropoxy)pentan-1-amine is sourced from PubChem (CID 62455814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).