N-(1-methoxypropan-2-yl)-5-(trifluoromethoxy)pyridin-2-amine

C10H13F3N2O2 — CID 133488159

IUPACN-(1-methoxypropan-2-yl)-5-(trifluoromethoxy)pyridin-2-amine
SMILESCOCC(C)Nc1ccc(OC(F)(F)F)cn1
InChIInChI=1S/C10H13F3N2O2/c1-7(6-16-2)15-9-4-3-8(5-14-9)17-10(11,12)13/h3-5,7H,6H2,1-2H3,(H,14,15)
InChIKeyRCARKVPAOLUJQZ-UHFFFAOYSA-N
MW250.22 g/mol
LogP2.43
Rot. Bonds5

About N-(1-methoxypropan-2-yl)-5-(trifluoromethoxy)pyridin-2-amine

N-(1-methoxypropan-2-yl)-5-(trifluoromethoxy)pyridin-2-amine (PubChem CID 133488159) has the molecular formula C10H13F3N2O2 and a molecular weight of 250.22 g/mol. Its IUPAC name is N-(1-methoxypropan-2-yl)-5-(trifluoromethoxy)pyridin-2-amine.

Molecular Properties

Compound NameN-(1-methoxypropan-2-yl)-5-(trifluoromethoxy)pyridin-2-amine
PubChem CID133488159
Molecular FormulaC10H13F3N2O2
Molecular Weight250.22 g/mol
Exact Mass250.09
IUPAC NameN-(1-methoxypropan-2-yl)-5-(trifluoromethoxy)pyridin-2-amine
SMILESCOCC(C)Nc1ccc(OC(F)(F)F)cn1
InChIInChI=1S/C10H13F3N2O2/c1-7(6-16-2)15-9-4-3-8(5-14-9)17-10(11,12)13/h3-5,7H,6H2,1-2H3,(H,14,15)
InChIKeyRCARKVPAOLUJQZ-UHFFFAOYSA-N
XLogP2.43
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.22
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1-methoxypropan-2-yl)-5-(trifluoromethoxy)pyridin-2-amine?
The IUPAC name of N-(1-methoxypropan-2-yl)-5-(trifluoromethoxy)pyridin-2-amine (CID 133488159) is N-(1-methoxypropan-2-yl)-5-(trifluoromethoxy)pyridin-2-amine.
What is the SMILES notation for N-(1-methoxypropan-2-yl)-5-(trifluoromethoxy)pyridin-2-amine?
The canonical SMILES for N-(1-methoxypropan-2-yl)-5-(trifluoromethoxy)pyridin-2-amine is COCC(C)Nc1ccc(OC(F)(F)F)cn1.
What is the InChIKey of N-(1-methoxypropan-2-yl)-5-(trifluoromethoxy)pyridin-2-amine?
The InChIKey is RCARKVPAOLUJQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13F3N2O2/c1-7(6-16-2)15-9-4-3-8(5-14-9)17-10(11,12)13/h3-5,7H,6H2,1-2H3,(H,14,15).
What are the key properties of N-(1-methoxypropan-2-yl)-5-(trifluoromethoxy)pyridin-2-amine?
N-(1-methoxypropan-2-yl)-5-(trifluoromethoxy)pyridin-2-amine has a molecular weight of 250.22 g/mol, XLogP of 2.43, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methoxypropan-2-yl)-5-(trifluoromethoxy)pyridin-2-amine is sourced from PubChem (CID 133488159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).