N-(2-fluoroethyl)-1-hexan-3-yl-4,5-dihydroimidazol-2-amine

C11H22FN3 — CID 146245885

IUPACN-(2-fluoroethyl)-1-hexan-3-yl-4,5-dihydroimidazol-2-amine
SMILESCCCC(CC)N1CCN=C1NCCF
InChIInChI=1S/C11H22FN3/c1-3-5-10(4-2)15-9-8-14-11(15)13-7-6-12/h10H,3-9H2,1-2H3,(H,13,14)
InChIKeyWZDJPEHTFWCFSS-UHFFFAOYSA-N
MW215.32 g/mol
LogP1.80
Rot. Bonds6

About N-(2-fluoroethyl)-1-hexan-3-yl-4,5-dihydroimidazol-2-amine

N-(2-fluoroethyl)-1-hexan-3-yl-4,5-dihydroimidazol-2-amine (PubChem CID 146245885) has the molecular formula C11H22FN3 and a molecular weight of 215.32 g/mol. Its IUPAC name is N-(2-fluoroethyl)-1-hexan-3-yl-4,5-dihydroimidazol-2-amine.

Molecular Properties

Compound NameN-(2-fluoroethyl)-1-hexan-3-yl-4,5-dihydroimidazol-2-amine
PubChem CID146245885
Molecular FormulaC11H22FN3
Molecular Weight215.32 g/mol
Exact Mass215.18
IUPAC NameN-(2-fluoroethyl)-1-hexan-3-yl-4,5-dihydroimidazol-2-amine
SMILESCCCC(CC)N1CCN=C1NCCF
InChIInChI=1S/C11H22FN3/c1-3-5-10(4-2)15-9-8-14-11(15)13-7-6-12/h10H,3-9H2,1-2H3,(H,13,14)
InChIKeyWZDJPEHTFWCFSS-UHFFFAOYSA-N
XLogP1.80
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.32
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(5R)-1,5-dibutyl-4,5-dihydroimidazol-2-amine
CID 23640888
(4S)-1-[4-[(5S)-2-amino-4,5-dihydro-1H-imidazol-5-yl]butyl]-4-butyl-4,5-dihydroimidazol-2-amine
CID 145963441
1-[4-[(5S)-2-amino-4,5-dihydro-1H-imidazol-5-yl]butyl]-4,5-dihydroimidazol-2-amine
CID 145963568
(5S)-5-(4-aminobutyl)-1-butyl-4,5-dihydroimidazol-2-amine
CID 23640806
N-(2-fluoroethyl)-1-propan-2-yl-4,5-dihydroimidazol-2-amine
CID 117682042
1-tert-butyl-N-(2-fluoroethyl)-4,5-dihydroimidazol-2-amine
CID 126487885
1-butan-2-yl-N-(2-fluoroethyl)-4,5-dihydroimidazol-2-amine
CID 138502581
2-(2-Fluoroethyl)-1-hexan-3-ylguanidine
CID 138502697
N-(4-fluorocyclohexyl)-4,5-dihydro-1H-imidazol-2-amine
CID 140556876
N-(2-fluoroethyl)-1-propyl-4,5-dihydroimidazol-2-amine
CID 146245866
2-(2-Fluoroethyl)-1-pentan-2-ylguanidine
CID 146245919
1-N-(2-aminoethyl)-7-N-(4,5-dihydro-1H-imidazol-2-yl)nonane-1,7-diamine
CID 91018359

Frequently Asked Questions

What is the IUPAC name of N-(2-fluoroethyl)-1-hexan-3-yl-4,5-dihydroimidazol-2-amine?
The IUPAC name of N-(2-fluoroethyl)-1-hexan-3-yl-4,5-dihydroimidazol-2-amine (CID 146245885) is N-(2-fluoroethyl)-1-hexan-3-yl-4,5-dihydroimidazol-2-amine.
What is the SMILES notation for N-(2-fluoroethyl)-1-hexan-3-yl-4,5-dihydroimidazol-2-amine?
The canonical SMILES for N-(2-fluoroethyl)-1-hexan-3-yl-4,5-dihydroimidazol-2-amine is CCCC(CC)N1CCN=C1NCCF.
What is the InChIKey of N-(2-fluoroethyl)-1-hexan-3-yl-4,5-dihydroimidazol-2-amine?
The InChIKey is WZDJPEHTFWCFSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22FN3/c1-3-5-10(4-2)15-9-8-14-11(15)13-7-6-12/h10H,3-9H2,1-2H3,(H,13,14).
What are the key properties of N-(2-fluoroethyl)-1-hexan-3-yl-4,5-dihydroimidazol-2-amine?
N-(2-fluoroethyl)-1-hexan-3-yl-4,5-dihydroimidazol-2-amine has a molecular weight of 215.32 g/mol, XLogP of 1.80, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoroethyl)-1-hexan-3-yl-4,5-dihydroimidazol-2-amine is sourced from PubChem (CID 146245885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).