3-(5-fluoro-3-pyridinyl)cyclohex-2-en-1-amine

C11H13FN2 — CID 65172310

IUPAC3-(5-fluoro-3-pyridinyl)cyclohex-2-en-1-amine
SMILESNC1C=C(c2cncc(F)c2)CCC1
InChIInChI=1S/C11H13FN2/c12-10-4-9(6-14-7-10)8-2-1-3-11(13)5-8/h4-7,11H,1-3,13H2
InChIKeyLWQJCIVMAMUJEK-UHFFFAOYSA-N
MW192.24 g/mol
LogP2.12
Rot. Bonds1

About 3-(5-fluoro-3-pyridinyl)cyclohex-2-en-1-amine

3-(5-fluoro-3-pyridinyl)cyclohex-2-en-1-amine (PubChem CID 65172310) has the molecular formula C11H13FN2 and a molecular weight of 192.24 g/mol. Its IUPAC name is 3-(5-fluoro-3-pyridinyl)cyclohex-2-en-1-amine.

Molecular Properties

Compound Name3-(5-fluoro-3-pyridinyl)cyclohex-2-en-1-amine
PubChem CID65172310
Molecular FormulaC11H13FN2
Molecular Weight192.24 g/mol
Exact Mass192.11
IUPAC Name3-(5-fluoro-3-pyridinyl)cyclohex-2-en-1-amine
SMILESNC1C=C(c2cncc(F)c2)CCC1
InChIInChI=1S/C11H13FN2/c12-10-4-9(6-14-7-10)8-2-1-3-11(13)5-8/h4-7,11H,1-3,13H2
InChIKeyLWQJCIVMAMUJEK-UHFFFAOYSA-N
XLogP2.12
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.24
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(5-fluoro-3-pyridinyl)cyclohept-2-en-1-ol
CID 107383485
3-(3-fluorophenyl)cyclohex-2-en-1-amine
CID 65171853
3-(5-propan-2-yloxy-3-pyridinyl)cyclohept-2-en-1-amine
CID 107383070
3-quinolin-3-ylcyclohept-2-en-1-amine
CID 107383271
3-[4-(4-fluorophenyl)phenyl]cyclopent-2-en-1-amine
CID 82298493
3-(3,5-difluorophenyl)cyclohex-2-en-1-ol
CID 65177157
3-(5-fluoro-2-methylphenyl)cyclohept-2-en-1-amine
CID 107383087
3-(5-fluoro-3-pyridinyl)-5,5-dimethylcyclohex-2-en-1-ol
CID 65177093
3-(2,3-dihydro-1-benzofuran-5-yl)cyclohept-2-en-1-amine
CID 107383052
1-(5-fluoro-3-pyridinyl)pyrrolidin-2-amine
CID 69205439
3-[2-(trifluoromethyl)phenyl]cyclohex-2-en-1-amine
CID 65171992
3-(2,6-difluoro-3-methylphenyl)cyclohept-2-en-1-amine
CID 107383018

Frequently Asked Questions

What is the IUPAC name of 3-(5-fluoro-3-pyridinyl)cyclohex-2-en-1-amine?
The IUPAC name of 3-(5-fluoro-3-pyridinyl)cyclohex-2-en-1-amine (CID 65172310) is 3-(5-fluoro-3-pyridinyl)cyclohex-2-en-1-amine.
What is the SMILES notation for 3-(5-fluoro-3-pyridinyl)cyclohex-2-en-1-amine?
The canonical SMILES for 3-(5-fluoro-3-pyridinyl)cyclohex-2-en-1-amine is NC1C=C(c2cncc(F)c2)CCC1.
What is the InChIKey of 3-(5-fluoro-3-pyridinyl)cyclohex-2-en-1-amine?
The InChIKey is LWQJCIVMAMUJEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FN2/c12-10-4-9(6-14-7-10)8-2-1-3-11(13)5-8/h4-7,11H,1-3,13H2.
What are the key properties of 3-(5-fluoro-3-pyridinyl)cyclohex-2-en-1-amine?
3-(5-fluoro-3-pyridinyl)cyclohex-2-en-1-amine has a molecular weight of 192.24 g/mol, XLogP of 2.12, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-fluoro-3-pyridinyl)cyclohex-2-en-1-amine is sourced from PubChem (CID 65172310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).