N-propan-2-yl-5-(2,2,2-trifluoroethoxy)pyridin-2-amine

C10H13F3N2O — CID 169237349

IUPACN-propan-2-yl-5-(2,2,2-trifluoroethoxy)pyridin-2-amine
SMILESCC(C)Nc1ccc(OCC(F)(F)F)cn1
InChIInChI=1S/C10H13F3N2O/c1-7(2)15-9-4-3-8(5-14-9)16-6-10(11,12)13/h3-5,7H,6H2,1-2H3,(H,14,15)
InChIKeyMFBXHVVCXUVISK-UHFFFAOYSA-N
MW234.22 g/mol
LogP2.84
Rot. Bonds4

About N-propan-2-yl-5-(2,2,2-trifluoroethoxy)pyridin-2-amine

N-propan-2-yl-5-(2,2,2-trifluoroethoxy)pyridin-2-amine (PubChem CID 169237349) has the molecular formula C10H13F3N2O and a molecular weight of 234.22 g/mol. Its IUPAC name is N-propan-2-yl-5-(2,2,2-trifluoroethoxy)pyridin-2-amine.

Molecular Properties

Compound NameN-propan-2-yl-5-(2,2,2-trifluoroethoxy)pyridin-2-amine
PubChem CID169237349
Molecular FormulaC10H13F3N2O
Molecular Weight234.22 g/mol
Exact Mass234.10
IUPAC NameN-propan-2-yl-5-(2,2,2-trifluoroethoxy)pyridin-2-amine
SMILESCC(C)Nc1ccc(OCC(F)(F)F)cn1
InChIInChI=1S/C10H13F3N2O/c1-7(2)15-9-4-3-8(5-14-9)16-6-10(11,12)13/h3-5,7H,6H2,1-2H3,(H,14,15)
InChIKeyMFBXHVVCXUVISK-UHFFFAOYSA-N
XLogP2.84
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.22
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

ethane;N-propan-2-yl-5-(trifluoromethoxy)pyridin-2-amine
CID 169238058
N-propan-2-yl-4-(2,2,2-trifluoroethoxy)aniline
CID 43425654
N-[[5-(2,2,2-trifluoroethoxy)-2-pyridinyl]methyl]propan-2-amine
CID 79781711
2-(3-methylpentan-2-yl)-5-(2,2,2-trifluoroethoxy)pyridine
CID 91558909
N-(1-methoxypropan-2-yl)-5-(trifluoromethoxy)pyridin-2-amine
CID 133488159
5-(difluoromethyl)-N-propan-2-ylpyridin-2-amine;ethane
CID 169237953
N-(3-methylbutan-2-yl)-4-(2,2,2-trifluoroethoxy)aniline
CID 43686735
1-[5-(2,2,2-trifluoroethoxy)-2-pyridinyl]propan-1-amine
CID 112584686
N-butan-2-yl-4-(2,2,2-trifluoroethoxy)aniline
CID 43686731
5-methoxy-N-(4-methoxybutan-2-yl)pyridin-2-amine
CID 103932146
2-chloro-N-[1-[5-(2,2,2-trifluoroethoxy)-2-pyridinyl]ethyl]acetamide
CID 118497793
acetylene;1,4-bis(2,2,2-trifluoroethoxy)benzene;ethane
CID 143388365

Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-5-(2,2,2-trifluoroethoxy)pyridin-2-amine?
The IUPAC name of N-propan-2-yl-5-(2,2,2-trifluoroethoxy)pyridin-2-amine (CID 169237349) is N-propan-2-yl-5-(2,2,2-trifluoroethoxy)pyridin-2-amine.
What is the SMILES notation for N-propan-2-yl-5-(2,2,2-trifluoroethoxy)pyridin-2-amine?
The canonical SMILES for N-propan-2-yl-5-(2,2,2-trifluoroethoxy)pyridin-2-amine is CC(C)Nc1ccc(OCC(F)(F)F)cn1.
What is the InChIKey of N-propan-2-yl-5-(2,2,2-trifluoroethoxy)pyridin-2-amine?
The InChIKey is MFBXHVVCXUVISK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13F3N2O/c1-7(2)15-9-4-3-8(5-14-9)16-6-10(11,12)13/h3-5,7H,6H2,1-2H3,(H,14,15).
What are the key properties of N-propan-2-yl-5-(2,2,2-trifluoroethoxy)pyridin-2-amine?
N-propan-2-yl-5-(2,2,2-trifluoroethoxy)pyridin-2-amine has a molecular weight of 234.22 g/mol, XLogP of 2.84, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-5-(2,2,2-trifluoroethoxy)pyridin-2-amine is sourced from PubChem (CID 169237349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).