N-(3-methoxycyclobutyl)-5-(trifluoromethyl)pyridin-2-amine

C11H13F3N2O — CID 104576703

IUPACN-(3-methoxycyclobutyl)-5-(trifluoromethyl)pyridin-2-amine
SMILESCOC1CC(Nc2ccc(C(F)(F)F)cn2)C1
InChIInChI=1S/C11H13F3N2O/c1-17-9-4-8(5-9)16-10-3-2-7(6-15-10)11(12,13)14/h2-3,6,8-9H,4-5H2,1H3,(H,15,16)
InChIKeyRJXWBGNMUBEVOX-UHFFFAOYSA-N
MW246.23 g/mol
LogP2.69
Rot. Bonds3

About N-(3-methoxycyclobutyl)-5-(trifluoromethyl)pyridin-2-amine

N-(3-methoxycyclobutyl)-5-(trifluoromethyl)pyridin-2-amine (PubChem CID 104576703) has the molecular formula C11H13F3N2O and a molecular weight of 246.23 g/mol. Its IUPAC name is N-(3-methoxycyclobutyl)-5-(trifluoromethyl)pyridin-2-amine.

Molecular Properties

Compound NameN-(3-methoxycyclobutyl)-5-(trifluoromethyl)pyridin-2-amine
PubChem CID104576703
Molecular FormulaC11H13F3N2O
Molecular Weight246.23 g/mol
Exact Mass246.10
IUPAC NameN-(3-methoxycyclobutyl)-5-(trifluoromethyl)pyridin-2-amine
SMILESCOC1CC(Nc2ccc(C(F)(F)F)cn2)C1
InChIInChI=1S/C11H13F3N2O/c1-17-9-4-8(5-9)16-10-3-2-7(6-15-10)11(12,13)14/h2-3,6,8-9H,4-5H2,1H3,(H,15,16)
InChIKeyRJXWBGNMUBEVOX-UHFFFAOYSA-N
XLogP2.69
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.23
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3R,5R)-3,5-dimethylcyclohexyl]-5-(trifluoromethyl)pyridin-2-amine
CID 97030726
methyl 4-[[5-(trifluoromethyl)-2-pyridinyl]amino]piperidine-1-carboxylate
CID 133273523
N-(3,4-dimethylcyclohexyl)-5-(trifluoromethyl)pyridin-2-amine
CID 64742884
N-(4-ethylcyclohexyl)-5-(trifluoromethyl)pyridin-2-amine
CID 63540704
N-piperidin-4-yl-5-(trifluoromethyl)pyridin-2-amine;trihydrochloride
CID 86276661
N-cyclopropyl-5-(2-methoxypropan-2-yl)pyridin-2-amine
CID 59869056
3-[[5-(trifluoromethyl)-2-pyridinyl]amino]cyclopentane-1-carboxylic acid
CID 66032182
N-(3-methoxycyclobutyl)-6-(trifluoromethyl)pyridin-3-amine
CID 106821586
4-[[5-(trifluoromethyl)-2-pyridinyl]amino]cyclohexane-1-sulfinic acid
CID 164877980
3-[(5-tert-butyl-2-pyridinyl)amino]cyclobutan-1-ol
CID 107874766
4-[[5-(trifluoromethyl)-2-pyridinyl]amino]cyclopent-2-ene-1-carboxylic acid
CID 79216388
5-bromo-N-(3-methoxycyclopentyl)pyridin-2-amine
CID 103081976

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxycyclobutyl)-5-(trifluoromethyl)pyridin-2-amine?
The IUPAC name of N-(3-methoxycyclobutyl)-5-(trifluoromethyl)pyridin-2-amine (CID 104576703) is N-(3-methoxycyclobutyl)-5-(trifluoromethyl)pyridin-2-amine.
What is the SMILES notation for N-(3-methoxycyclobutyl)-5-(trifluoromethyl)pyridin-2-amine?
The canonical SMILES for N-(3-methoxycyclobutyl)-5-(trifluoromethyl)pyridin-2-amine is COC1CC(Nc2ccc(C(F)(F)F)cn2)C1.
What is the InChIKey of N-(3-methoxycyclobutyl)-5-(trifluoromethyl)pyridin-2-amine?
The InChIKey is RJXWBGNMUBEVOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13F3N2O/c1-17-9-4-8(5-9)16-10-3-2-7(6-15-10)11(12,13)14/h2-3,6,8-9H,4-5H2,1H3,(H,15,16).
What are the key properties of N-(3-methoxycyclobutyl)-5-(trifluoromethyl)pyridin-2-amine?
N-(3-methoxycyclobutyl)-5-(trifluoromethyl)pyridin-2-amine has a molecular weight of 246.23 g/mol, XLogP of 2.69, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxycyclobutyl)-5-(trifluoromethyl)pyridin-2-amine is sourced from PubChem (CID 104576703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).