N'-tert-butyl-N-(2-fluoroethyl)-N,N'-dimethylethane-1,2-diamine

C10H23FN2 — CID 123453262

IUPACN'-tert-butyl-N-(2-fluoroethyl)-N,N'-dimethylethane-1,2-diamine
SMILESCN(CCF)CCN(C)C(C)(C)C
InChIInChI=1S/C10H23FN2/c1-10(2,3)13(5)9-8-12(4)7-6-11/h6-9H2,1-5H3
InChIKeyGBTDDOPIPNPEJE-UHFFFAOYSA-N
MW190.31 g/mol
LogP1.62
Rot. Bonds5

About N'-tert-butyl-N-(2-fluoroethyl)-N,N'-dimethylethane-1,2-diamine

N'-tert-butyl-N-(2-fluoroethyl)-N,N'-dimethylethane-1,2-diamine (PubChem CID 123453262) has the molecular formula C10H23FN2 and a molecular weight of 190.31 g/mol. Its IUPAC name is N'-tert-butyl-N-(2-fluoroethyl)-N,N'-dimethylethane-1,2-diamine.

Molecular Properties

Compound NameN'-tert-butyl-N-(2-fluoroethyl)-N,N'-dimethylethane-1,2-diamine
PubChem CID123453262
Molecular FormulaC10H23FN2
Molecular Weight190.31 g/mol
Exact Mass190.18
IUPAC NameN'-tert-butyl-N-(2-fluoroethyl)-N,N'-dimethylethane-1,2-diamine
SMILESCN(CCF)CCN(C)C(C)(C)C
InChIInChI=1S/C10H23FN2/c1-10(2,3)13(5)9-8-12(4)7-6-11/h6-9H2,1-5H3
InChIKeyGBTDDOPIPNPEJE-UHFFFAOYSA-N
XLogP1.62
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.31
LogP ≤ 51.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N'-tert-butyl-N-(2-fluoroethyl)-N,N'-dimethylethane-1,2-diamine?
The IUPAC name of N'-tert-butyl-N-(2-fluoroethyl)-N,N'-dimethylethane-1,2-diamine (CID 123453262) is N'-tert-butyl-N-(2-fluoroethyl)-N,N'-dimethylethane-1,2-diamine.
What is the SMILES notation for N'-tert-butyl-N-(2-fluoroethyl)-N,N'-dimethylethane-1,2-diamine?
The canonical SMILES for N'-tert-butyl-N-(2-fluoroethyl)-N,N'-dimethylethane-1,2-diamine is CN(CCF)CCN(C)C(C)(C)C.
What is the InChIKey of N'-tert-butyl-N-(2-fluoroethyl)-N,N'-dimethylethane-1,2-diamine?
The InChIKey is GBTDDOPIPNPEJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23FN2/c1-10(2,3)13(5)9-8-12(4)7-6-11/h6-9H2,1-5H3.
What are the key properties of N'-tert-butyl-N-(2-fluoroethyl)-N,N'-dimethylethane-1,2-diamine?
N'-tert-butyl-N-(2-fluoroethyl)-N,N'-dimethylethane-1,2-diamine has a molecular weight of 190.31 g/mol, XLogP of 1.62, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-tert-butyl-N-(2-fluoroethyl)-N,N'-dimethylethane-1,2-diamine is sourced from PubChem (CID 123453262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).