4-N-(5-fluoro-2-pyridinyl)cyclohexane-1,4-diamine

C11H16FN3 — CID 62312959

IUPAC4-N-(5-fluoro-2-pyridinyl)cyclohexane-1,4-diamine
SMILESNC1CCC(Nc2ccc(F)cn2)CC1
InChIInChI=1S/C11H16FN3/c12-8-1-6-11(14-7-8)15-10-4-2-9(13)3-5-10/h1,6-7,9-10H,2-5,13H2,(H,14,15)
InChIKeyATWZGUAAUHTKEH-UHFFFAOYSA-N
MW209.27 g/mol
LogP1.90
Rot. Bonds2

About 4-N-(5-fluoro-2-pyridinyl)cyclohexane-1,4-diamine

4-N-(5-fluoro-2-pyridinyl)cyclohexane-1,4-diamine (PubChem CID 62312959) has the molecular formula C11H16FN3 and a molecular weight of 209.27 g/mol. Its IUPAC name is 4-N-(5-fluoro-2-pyridinyl)cyclohexane-1,4-diamine.

Molecular Properties

Compound Name4-N-(5-fluoro-2-pyridinyl)cyclohexane-1,4-diamine
PubChem CID62312959
Molecular FormulaC11H16FN3
Molecular Weight209.27 g/mol
Exact Mass209.13
IUPAC Name4-N-(5-fluoro-2-pyridinyl)cyclohexane-1,4-diamine
SMILESNC1CCC(Nc2ccc(F)cn2)CC1
InChIInChI=1S/C11H16FN3/c12-8-1-6-11(14-7-8)15-10-4-2-9(13)3-5-10/h1,6-7,9-10H,2-5,13H2,(H,14,15)
InChIKeyATWZGUAAUHTKEH-UHFFFAOYSA-N
XLogP1.90
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.27
LogP ≤ 51.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-N-(5-fluoro-2-pyridinyl)cyclohexane-1,4-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-cyclopropyl-5-fluoropyridin-2-amine
CID 61313330
4-N-(5-methyl-2-pyridinyl)cyclohexane-1,4-diamine;dihydrochloride
CID 86694119
4-N-(5-tert-butyl-2-pyridinyl)cyclohexane-1,4-diamine
CID 114011527
N-[(4-aminocyclohexyl)methyl]-5-fluoropyridin-2-amine
CID 106128725
N-(3-bicyclo[3.1.0]hexanyl)-5-fluoropyridin-2-amine
CID 130791657
6-[(4-aminocyclohexyl)amino]pyridine-3-carboxamide
CID 58337929
1-N-(5-fluoro-2-pyridinyl)cyclopropane-1,2-diamine
CID 61312363
6-[(4-aminocyclohexyl)amino]pyridine-3-sulfonamide
CID 62321102
5-fluoro-N-[(3R)-pyrrolidin-3-yl]pyridin-2-amine
CID 58254860
4-N-(5-nitro-2-pyridinyl)cyclohexane-1,4-diamine
CID 22591359
2-[4-[(5-fluoro-2-pyridinyl)amino]piperidin-1-yl]acetamide
CID 61311404
2-N-cyclopropylpyridine-2,5-diamine
CID 16776026

Frequently Asked Questions

What is the IUPAC name of 4-N-(5-fluoro-2-pyridinyl)cyclohexane-1,4-diamine?
The IUPAC name of 4-N-(5-fluoro-2-pyridinyl)cyclohexane-1,4-diamine (CID 62312959) is 4-N-(5-fluoro-2-pyridinyl)cyclohexane-1,4-diamine.
What is the SMILES notation for 4-N-(5-fluoro-2-pyridinyl)cyclohexane-1,4-diamine?
The canonical SMILES for 4-N-(5-fluoro-2-pyridinyl)cyclohexane-1,4-diamine is NC1CCC(Nc2ccc(F)cn2)CC1.
What is the InChIKey of 4-N-(5-fluoro-2-pyridinyl)cyclohexane-1,4-diamine?
The InChIKey is ATWZGUAAUHTKEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16FN3/c12-8-1-6-11(14-7-8)15-10-4-2-9(13)3-5-10/h1,6-7,9-10H,2-5,13H2,(H,14,15).
What are the key properties of 4-N-(5-fluoro-2-pyridinyl)cyclohexane-1,4-diamine?
4-N-(5-fluoro-2-pyridinyl)cyclohexane-1,4-diamine has a molecular weight of 209.27 g/mol, XLogP of 1.90, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(5-fluoro-2-pyridinyl)cyclohexane-1,4-diamine is sourced from PubChem (CID 62312959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).