1-(4-fluorocyclohexyl)imidazolidine

C9H17FN2 — CID 44558741

IUPAC1-(4-fluorocyclohexyl)imidazolidine
SMILESFC1CCC(N2CCNC2)CC1
InChIInChI=1S/C9H17FN2/c10-8-1-3-9(4-2-8)12-6-5-11-7-12/h8-9,11H,1-7H2
InChIKeyNXNZIKMHVADMAE-UHFFFAOYSA-N
MW172.25 g/mol
LogP1.13
Rot. Bonds1

About 1-(4-fluorocyclohexyl)imidazolidine

1-(4-fluorocyclohexyl)imidazolidine (PubChem CID 44558741) has the molecular formula C9H17FN2 and a molecular weight of 172.25 g/mol. Its IUPAC name is 1-(4-fluorocyclohexyl)imidazolidine.

Molecular Properties

Compound Name1-(4-fluorocyclohexyl)imidazolidine
PubChem CID44558741
Molecular FormulaC9H17FN2
Molecular Weight172.25 g/mol
Exact Mass172.14
IUPAC Name1-(4-fluorocyclohexyl)imidazolidine
SMILESFC1CCC(N2CCNC2)CC1
InChIInChI=1S/C9H17FN2/c10-8-1-3-9(4-2-8)12-6-5-11-7-12/h8-9,11H,1-7H2
InChIKeyNXNZIKMHVADMAE-UHFFFAOYSA-N
XLogP1.13
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.25
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorocyclohexyl)imidazolidine?
The IUPAC name of 1-(4-fluorocyclohexyl)imidazolidine (CID 44558741) is 1-(4-fluorocyclohexyl)imidazolidine.
What is the SMILES notation for 1-(4-fluorocyclohexyl)imidazolidine?
The canonical SMILES for 1-(4-fluorocyclohexyl)imidazolidine is FC1CCC(N2CCNC2)CC1.
What is the InChIKey of 1-(4-fluorocyclohexyl)imidazolidine?
The InChIKey is NXNZIKMHVADMAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17FN2/c10-8-1-3-9(4-2-8)12-6-5-11-7-12/h8-9,11H,1-7H2.
What are the key properties of 1-(4-fluorocyclohexyl)imidazolidine?
1-(4-fluorocyclohexyl)imidazolidine has a molecular weight of 172.25 g/mol, XLogP of 1.13, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorocyclohexyl)imidazolidine is sourced from PubChem (CID 44558741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).