1-(5-fluoro-2-pyridinyl)-1-(4-methylcyclohexyl)propan-1-amine

C15H23FN2 — CID 112585949

IUPAC1-(5-fluoro-2-pyridinyl)-1-(4-methylcyclohexyl)propan-1-amine
SMILESCCC(N)(c1ccc(F)cn1)C1CCC(C)CC1
InChIInChI=1S/C15H23FN2/c1-3-15(17,12-6-4-11(2)5-7-12)14-9-8-13(16)10-18-14/h8-12H,3-7,17H2,1-2H3
InChIKeyRFLRSIFYGORXSH-UHFFFAOYSA-N
MW250.36 g/mol
LogP3.61
Rot. Bonds3

About 1-(5-fluoro-2-pyridinyl)-1-(4-methylcyclohexyl)propan-1-amine

1-(5-fluoro-2-pyridinyl)-1-(4-methylcyclohexyl)propan-1-amine (PubChem CID 112585949) has the molecular formula C15H23FN2 and a molecular weight of 250.36 g/mol. Its IUPAC name is 1-(5-fluoro-2-pyridinyl)-1-(4-methylcyclohexyl)propan-1-amine.

Molecular Properties

Compound Name1-(5-fluoro-2-pyridinyl)-1-(4-methylcyclohexyl)propan-1-amine
PubChem CID112585949
Molecular FormulaC15H23FN2
Molecular Weight250.36 g/mol
Exact Mass250.18
IUPAC Name1-(5-fluoro-2-pyridinyl)-1-(4-methylcyclohexyl)propan-1-amine
SMILESCCC(N)(c1ccc(F)cn1)C1CCC(C)CC1
InChIInChI=1S/C15H23FN2/c1-3-15(17,12-6-4-11(2)5-7-12)14-9-8-13(16)10-18-14/h8-12H,3-7,17H2,1-2H3
InChIKeyRFLRSIFYGORXSH-UHFFFAOYSA-N
XLogP3.61
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.36
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3,4-dimethylcyclohexyl)-1-(5-fluoro-2-pyridinyl)propan-1-amine
CID 112586065
3-(5-fluoro-2-pyridinyl)-5-methylhexan-3-amine
CID 112585951
1-cyclohexyl-1-(5-fluoro-2-pyridinyl)propan-1-ol
CID 112585853
1-cyclohexyl-2-(5-fluoro-2-pyridinyl)propan-2-amine
CID 83125019
3-(5-fluoro-2-pyridinyl)pent-1-en-3-amine
CID 130655519
2-(5-fluoro-2-pyridinyl)butan-2-ol
CID 83124844
1-(1-ethylimidazol-2-yl)-2-(5-fluoro-2-pyridinyl)butan-2-amine
CID 112586055
ethyl 2-(cyclopropylamino)-2-(5-fluoro-2-pyridinyl)propanoate
CID 83120217
N-[(4-methylcyclohexyl)methyl]-6-(trifluoromethyl)pyridin-3-amine
CID 70919588
1-(5-fluoro-2-pyridinyl)-1-thiophen-3-ylpropan-1-amine
CID 112586080
2-(5-fluoro-2-pyridinyl)-5,5-dimethylhexan-2-amine
CID 83124633
2-(5-fluoro-2-pyridinyl)-1-(oxan-4-yl)butan-2-ol
CID 112585844

Frequently Asked Questions

What is the IUPAC name of 1-(5-fluoro-2-pyridinyl)-1-(4-methylcyclohexyl)propan-1-amine?
The IUPAC name of 1-(5-fluoro-2-pyridinyl)-1-(4-methylcyclohexyl)propan-1-amine (CID 112585949) is 1-(5-fluoro-2-pyridinyl)-1-(4-methylcyclohexyl)propan-1-amine.
What is the SMILES notation for 1-(5-fluoro-2-pyridinyl)-1-(4-methylcyclohexyl)propan-1-amine?
The canonical SMILES for 1-(5-fluoro-2-pyridinyl)-1-(4-methylcyclohexyl)propan-1-amine is CCC(N)(c1ccc(F)cn1)C1CCC(C)CC1.
What is the InChIKey of 1-(5-fluoro-2-pyridinyl)-1-(4-methylcyclohexyl)propan-1-amine?
The InChIKey is RFLRSIFYGORXSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23FN2/c1-3-15(17,12-6-4-11(2)5-7-12)14-9-8-13(16)10-18-14/h8-12H,3-7,17H2,1-2H3.
What are the key properties of 1-(5-fluoro-2-pyridinyl)-1-(4-methylcyclohexyl)propan-1-amine?
1-(5-fluoro-2-pyridinyl)-1-(4-methylcyclohexyl)propan-1-amine has a molecular weight of 250.36 g/mol, XLogP of 3.61, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-fluoro-2-pyridinyl)-1-(4-methylcyclohexyl)propan-1-amine is sourced from PubChem (CID 112585949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).