N-[1-(5-fluoro-2-pyridinyl)propyl]-3,5-dimethylcyclohexan-1-amine

C16H25FN2 — CID 112583178

IUPACN-[1-(5-fluoro-2-pyridinyl)propyl]-3,5-dimethylcyclohexan-1-amine
SMILESCCC(NC1CC(C)CC(C)C1)c1ccc(F)cn1
InChIInChI=1S/C16H25FN2/c1-4-15(16-6-5-13(17)10-18-16)19-14-8-11(2)7-12(3)9-14/h5-6,10-12,14-15,19H,4,7-9H2,1-3H3
InChIKeyYEFCVMYNJJXGBS-UHFFFAOYSA-N
MW264.39 g/mol
LogP4.09
Rot. Bonds4

About N-[1-(5-fluoro-2-pyridinyl)propyl]-3,5-dimethylcyclohexan-1-amine

N-[1-(5-fluoro-2-pyridinyl)propyl]-3,5-dimethylcyclohexan-1-amine (PubChem CID 112583178) has the molecular formula C16H25FN2 and a molecular weight of 264.39 g/mol. Its IUPAC name is N-[1-(5-fluoro-2-pyridinyl)propyl]-3,5-dimethylcyclohexan-1-amine.

Molecular Properties

Compound NameN-[1-(5-fluoro-2-pyridinyl)propyl]-3,5-dimethylcyclohexan-1-amine
PubChem CID112583178
Molecular FormulaC16H25FN2
Molecular Weight264.39 g/mol
Exact Mass264.20
IUPAC NameN-[1-(5-fluoro-2-pyridinyl)propyl]-3,5-dimethylcyclohexan-1-amine
SMILESCCC(NC1CC(C)CC(C)C1)c1ccc(F)cn1
InChIInChI=1S/C16H25FN2/c1-4-15(16-6-5-13(17)10-18-16)19-14-8-11(2)7-12(3)9-14/h5-6,10-12,14-15,19H,4,7-9H2,1-3H3
InChIKeyYEFCVMYNJJXGBS-UHFFFAOYSA-N
XLogP4.09
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.39
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[1-(5-fluoro-2-pyridinyl)propyl]-3,5-dimethylcyclohexan-1-amine with MolForge

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Related Compounds

N-[1-(5-fluoro-2-pyridinyl)propyl]-9-methyl-9-azabicyclo[3.3.1]nonan-3-amine
CID 115938758
N-[1-(5-fluoro-2-pyridinyl)propyl]-2,4-dimethylcyclohexan-1-amine
CID 112583154
N-[1-(5-fluoro-2-pyridinyl)propyl]-4-(trifluoromethyl)cyclohexan-1-amine
CID 115938586
1-butyl-N-[1-(5-fluoro-2-pyridinyl)propyl]piperidin-4-amine
CID 115938621
3-ethoxy-N-[1-(5-fluoro-2-pyridinyl)propyl]-2,2-dimethylcyclobutan-1-amine
CID 103948410
N-[1-(5-fluoro-2-pyridinyl)propyl]-1,3-dimethylpiperidin-4-amine
CID 114503283
2-[1-(5-fluoro-2-pyridinyl)propylamino]cyclopentane-1-carbonitrile
CID 112583121
N-[1-(5-fluoro-2-pyridinyl)propyl]but-2-yn-1-amine
CID 115975737
N-cyclopropyl-2-[1-(5-fluoro-2-pyridinyl)propylamino]acetamide
CID 112582965
2-[1-(5-fluoro-2-pyridinyl)propylamino]butan-1-ol
CID 112582914
N-(2,2-dimethoxyethyl)-1-(5-fluoro-2-pyridinyl)propan-1-amine
CID 112583006
N-[1-(4-ethylphenyl)propyl]-3,5-dimethylcyclohexan-1-amine
CID 64732839

Frequently Asked Questions

What is the IUPAC name of N-[1-(5-fluoro-2-pyridinyl)propyl]-3,5-dimethylcyclohexan-1-amine?
The IUPAC name of N-[1-(5-fluoro-2-pyridinyl)propyl]-3,5-dimethylcyclohexan-1-amine (CID 112583178) is N-[1-(5-fluoro-2-pyridinyl)propyl]-3,5-dimethylcyclohexan-1-amine.
What is the SMILES notation for N-[1-(5-fluoro-2-pyridinyl)propyl]-3,5-dimethylcyclohexan-1-amine?
The canonical SMILES for N-[1-(5-fluoro-2-pyridinyl)propyl]-3,5-dimethylcyclohexan-1-amine is CCC(NC1CC(C)CC(C)C1)c1ccc(F)cn1.
What is the InChIKey of N-[1-(5-fluoro-2-pyridinyl)propyl]-3,5-dimethylcyclohexan-1-amine?
The InChIKey is YEFCVMYNJJXGBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25FN2/c1-4-15(16-6-5-13(17)10-18-16)19-14-8-11(2)7-12(3)9-14/h5-6,10-12,14-15,19H,4,7-9H2,1-3H3.
What are the key properties of N-[1-(5-fluoro-2-pyridinyl)propyl]-3,5-dimethylcyclohexan-1-amine?
N-[1-(5-fluoro-2-pyridinyl)propyl]-3,5-dimethylcyclohexan-1-amine has a molecular weight of 264.39 g/mol, XLogP of 4.09, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(5-fluoro-2-pyridinyl)propyl]-3,5-dimethylcyclohexan-1-amine is sourced from PubChem (CID 112583178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).