N-ethyl-N-(2-fluoroethyl)propan-2-amine

C7H16FN — CID 91240271

IUPACN-ethyl-N-(2-fluoroethyl)propan-2-amine
SMILESCCN(CCF)C(C)C
InChIInChI=1S/C7H16FN/c1-4-9(6-5-8)7(2)3/h7H,4-6H2,1-3H3
InChIKeyBYVPKIGGEXLJPI-UHFFFAOYSA-N
MW133.21 g/mol
LogP1.69
Rot. Bonds4

About N-ethyl-N-(2-fluoroethyl)propan-2-amine

N-ethyl-N-(2-fluoroethyl)propan-2-amine (PubChem CID 91240271) has the molecular formula C7H16FN and a molecular weight of 133.21 g/mol. Its IUPAC name is N-ethyl-N-(2-fluoroethyl)propan-2-amine.

Molecular Properties

Compound NameN-ethyl-N-(2-fluoroethyl)propan-2-amine
PubChem CID91240271
Molecular FormulaC7H16FN
Molecular Weight133.21 g/mol
Exact Mass133.13
IUPAC NameN-ethyl-N-(2-fluoroethyl)propan-2-amine
SMILESCCN(CCF)C(C)C
InChIInChI=1S/C7H16FN/c1-4-9(6-5-8)7(2)3/h7H,4-6H2,1-3H3
InChIKeyBYVPKIGGEXLJPI-UHFFFAOYSA-N
XLogP1.69
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.21
LogP ≤ 51.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(2-fluoroethyl)propan-2-amine?
The IUPAC name of N-ethyl-N-(2-fluoroethyl)propan-2-amine (CID 91240271) is N-ethyl-N-(2-fluoroethyl)propan-2-amine.
What is the SMILES notation for N-ethyl-N-(2-fluoroethyl)propan-2-amine?
The canonical SMILES for N-ethyl-N-(2-fluoroethyl)propan-2-amine is CCN(CCF)C(C)C.
What is the InChIKey of N-ethyl-N-(2-fluoroethyl)propan-2-amine?
The InChIKey is BYVPKIGGEXLJPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16FN/c1-4-9(6-5-8)7(2)3/h7H,4-6H2,1-3H3.
What are the key properties of N-ethyl-N-(2-fluoroethyl)propan-2-amine?
N-ethyl-N-(2-fluoroethyl)propan-2-amine has a molecular weight of 133.21 g/mol, XLogP of 1.69, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(2-fluoroethyl)propan-2-amine is sourced from PubChem (CID 91240271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).