5-fluoro-N-(7-methyloctyl)pyridin-2-amine

C14H23FN2 — CID 107816143

IUPAC5-fluoro-N-(7-methyloctyl)pyridin-2-amine
SMILESCC(C)CCCCCCNc1ccc(F)cn1
InChIInChI=1S/C14H23FN2/c1-12(2)7-5-3-4-6-10-16-14-9-8-13(15)11-17-14/h8-9,11-12H,3-7,10H2,1-2H3,(H,16,17)
InChIKeyIPBJOUZVWASELO-UHFFFAOYSA-N
MW238.35 g/mol
LogP4.24
Rot. Bonds8

About 5-fluoro-N-(7-methyloctyl)pyridin-2-amine

5-fluoro-N-(7-methyloctyl)pyridin-2-amine (PubChem CID 107816143) has the molecular formula C14H23FN2 and a molecular weight of 238.35 g/mol. Its IUPAC name is 5-fluoro-N-(7-methyloctyl)pyridin-2-amine.

Molecular Properties

Compound Name5-fluoro-N-(7-methyloctyl)pyridin-2-amine
PubChem CID107816143
Molecular FormulaC14H23FN2
Molecular Weight238.35 g/mol
Exact Mass238.18
IUPAC Name5-fluoro-N-(7-methyloctyl)pyridin-2-amine
SMILESCC(C)CCCCCCNc1ccc(F)cn1
InChIInChI=1S/C14H23FN2/c1-12(2)7-5-3-4-6-10-16-14-9-8-13(15)11-17-14/h8-9,11-12H,3-7,10H2,1-2H3,(H,16,17)
InChIKeyIPBJOUZVWASELO-UHFFFAOYSA-N
XLogP4.24
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.35
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

(2S)-4-[(5-fluoro-2-pyridinyl)amino]butan-2-ol
CID 130918484
N-(5-fluoro-2-pyridinyl)-N'-methyl-N'-propan-2-ylpropane-1,3-diamine
CID 106048487
6-(5-methylhexylamino)pyridine-3-carboxamide
CID 79003295
5-N-(7-methyloctyl)pyridine-2,5-diamine
CID 107814726
5-fluoro-N-(2-fluoroethyl)pyridin-2-amine
CID 130504146
4-[(5-fluoro-2-pyridinyl)amino]-2-methylbutan-2-ol
CID 130561119
N-(2,3-dimethylbutyl)-5-fluoropyridin-2-amine
CID 64597559
6-(4-methylpentylamino)pyridine-3-carboxylic acid
CID 63002439
2-methyl-N-(7-methyloctyl)pyrimidin-4-amine
CID 107816212
1-[(5-fluoro-2-pyridinyl)amino]-4-methylpentan-2-ol
CID 107153298
5-(7-methyloctylamino)pyrazine-2-carboxylic acid
CID 107815534
N-[3-(4-aminocyclohexyl)oxypropyl]-5-fluoropyridin-2-amine
CID 63870709

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-N-(7-methyloctyl)pyridin-2-amine?
The IUPAC name of 5-fluoro-N-(7-methyloctyl)pyridin-2-amine (CID 107816143) is 5-fluoro-N-(7-methyloctyl)pyridin-2-amine.
What is the SMILES notation for 5-fluoro-N-(7-methyloctyl)pyridin-2-amine?
The canonical SMILES for 5-fluoro-N-(7-methyloctyl)pyridin-2-amine is CC(C)CCCCCCNc1ccc(F)cn1.
What is the InChIKey of 5-fluoro-N-(7-methyloctyl)pyridin-2-amine?
The InChIKey is IPBJOUZVWASELO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23FN2/c1-12(2)7-5-3-4-6-10-16-14-9-8-13(15)11-17-14/h8-9,11-12H,3-7,10H2,1-2H3,(H,16,17).
What are the key properties of 5-fluoro-N-(7-methyloctyl)pyridin-2-amine?
5-fluoro-N-(7-methyloctyl)pyridin-2-amine has a molecular weight of 238.35 g/mol, XLogP of 4.24, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-N-(7-methyloctyl)pyridin-2-amine is sourced from PubChem (CID 107816143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).