6-pentan-2-yloxy-N-propyl-4-(trifluoromethyl)pyridin-2-amine

C14H21F3N2O — CID 102989406

IUPAC6-pentan-2-yloxy-N-propyl-4-(trifluoromethyl)pyridin-2-amine
SMILESCCCNc1cc(C(F)(F)F)cc(OC(C)CCC)n1
InChIInChI=1S/C14H21F3N2O/c1-4-6-10(3)20-13-9-11(14(15,16)17)8-12(19-13)18-7-5-2/h8-10H,4-7H2,1-3H3,(H,18,19)
InChIKeyUQCICJCZQAKRSY-UHFFFAOYSA-N
MW290.33 g/mol
LogP4.49
Rot. Bonds7

About 6-pentan-2-yloxy-N-propyl-4-(trifluoromethyl)pyridin-2-amine

6-pentan-2-yloxy-N-propyl-4-(trifluoromethyl)pyridin-2-amine (PubChem CID 102989406) has the molecular formula C14H21F3N2O and a molecular weight of 290.33 g/mol. Its IUPAC name is 6-pentan-2-yloxy-N-propyl-4-(trifluoromethyl)pyridin-2-amine.

Molecular Properties

Compound Name6-pentan-2-yloxy-N-propyl-4-(trifluoromethyl)pyridin-2-amine
PubChem CID102989406
Molecular FormulaC14H21F3N2O
Molecular Weight290.33 g/mol
Exact Mass290.16
IUPAC Name6-pentan-2-yloxy-N-propyl-4-(trifluoromethyl)pyridin-2-amine
SMILESCCCNc1cc(C(F)(F)F)cc(OC(C)CCC)n1
InChIInChI=1S/C14H21F3N2O/c1-4-6-10(3)20-13-9-11(14(15,16)17)8-12(19-13)18-7-5-2/h8-10H,4-7H2,1-3H3,(H,18,19)
InChIKeyUQCICJCZQAKRSY-UHFFFAOYSA-N
XLogP4.49
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.33
LogP ≤ 54.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-(3-methylbutan-2-yloxy)-N-propyl-4-(trifluoromethyl)pyridin-2-amine
CID 102720055
6-(4-methylpentoxy)-N-propyl-4-(trifluoromethyl)pyridin-2-amine
CID 102719649
N-propyl-6-(2,2,2-trifluoroethoxy)-4-(trifluoromethyl)pyridin-2-amine
CID 102719676
N-methyl-6-octan-2-yloxy-4-(trifluoromethyl)pyridin-2-amine
CID 102719634
2-ethyl-6-pentan-2-yloxy-N-propylpyrimidin-4-amine
CID 102989348
N-ethyl-6-(1-methoxypropan-2-yloxy)-4-(trifluoromethyl)pyridin-2-amine
CID 102719983
6-(3,3-dimethylbutoxy)-N-propyl-4-(trifluoromethyl)pyridin-2-amine
CID 102720042
6-pentan-2-yloxy-N-propylpyrazin-2-amine
CID 102989461
1-[[6-(propylamino)-4-(trifluoromethyl)-2-pyridinyl]amino]pentan-2-ol
CID 102719358
6-N-(3-methylpentan-2-yl)-2-N-propyl-4-(trifluoromethyl)pyridine-2,6-diamine
CID 102717856
6-N-(2-methylbutyl)-2-N-propyl-4-(trifluoromethyl)pyridine-2,6-diamine
CID 102718352
6-cyclohexyloxy-N-propyl-4-(trifluoromethyl)pyridin-2-amine
CID 102719671

Frequently Asked Questions

What is the IUPAC name of 6-pentan-2-yloxy-N-propyl-4-(trifluoromethyl)pyridin-2-amine?
The IUPAC name of 6-pentan-2-yloxy-N-propyl-4-(trifluoromethyl)pyridin-2-amine (CID 102989406) is 6-pentan-2-yloxy-N-propyl-4-(trifluoromethyl)pyridin-2-amine.
What is the SMILES notation for 6-pentan-2-yloxy-N-propyl-4-(trifluoromethyl)pyridin-2-amine?
The canonical SMILES for 6-pentan-2-yloxy-N-propyl-4-(trifluoromethyl)pyridin-2-amine is CCCNc1cc(C(F)(F)F)cc(OC(C)CCC)n1.
What is the InChIKey of 6-pentan-2-yloxy-N-propyl-4-(trifluoromethyl)pyridin-2-amine?
The InChIKey is UQCICJCZQAKRSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21F3N2O/c1-4-6-10(3)20-13-9-11(14(15,16)17)8-12(19-13)18-7-5-2/h8-10H,4-7H2,1-3H3,(H,18,19).
What are the key properties of 6-pentan-2-yloxy-N-propyl-4-(trifluoromethyl)pyridin-2-amine?
6-pentan-2-yloxy-N-propyl-4-(trifluoromethyl)pyridin-2-amine has a molecular weight of 290.33 g/mol, XLogP of 4.49, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-pentan-2-yloxy-N-propyl-4-(trifluoromethyl)pyridin-2-amine is sourced from PubChem (CID 102989406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).