N-propan-2-yl-5-(trifluoromethyl)pyridin-2-amine

C9H11F3N2 — CID 2991704

IUPACN-propan-2-yl-5-(trifluoromethyl)pyridin-2-amine
SMILESCC(C)Nc1ccc(C(F)(F)F)cn1
InChIInChI=1S/C9H11F3N2/c1-6(2)14-8-4-3-7(5-13-8)9(10,11)12/h3-6H,1-2H3,(H,13,14)
InChIKeyXREHFRWADMHXHK-UHFFFAOYSA-N
MW204.19 g/mol
LogP2.92
Rot. Bonds2

About N-propan-2-yl-5-(trifluoromethyl)pyridin-2-amine

N-propan-2-yl-5-(trifluoromethyl)pyridin-2-amine (PubChem CID 2991704) has the molecular formula C9H11F3N2 and a molecular weight of 204.19 g/mol. Its IUPAC name is N-propan-2-yl-5-(trifluoromethyl)pyridin-2-amine.

Molecular Properties

Compound NameN-propan-2-yl-5-(trifluoromethyl)pyridin-2-amine
PubChem CID2991704
Molecular FormulaC9H11F3N2
Molecular Weight204.19 g/mol
Exact Mass204.09
IUPAC NameN-propan-2-yl-5-(trifluoromethyl)pyridin-2-amine
SMILESCC(C)Nc1ccc(C(F)(F)F)cn1
InChIInChI=1S/C9H11F3N2/c1-6(2)14-8-4-3-7(5-13-8)9(10,11)12/h3-6H,1-2H3,(H,13,14)
InChIKeyXREHFRWADMHXHK-UHFFFAOYSA-N
XLogP2.92
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.19
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-5-(trifluoromethyl)pyridin-2-amine?
The IUPAC name of N-propan-2-yl-5-(trifluoromethyl)pyridin-2-amine (CID 2991704) is N-propan-2-yl-5-(trifluoromethyl)pyridin-2-amine.
What is the SMILES notation for N-propan-2-yl-5-(trifluoromethyl)pyridin-2-amine?
The canonical SMILES for N-propan-2-yl-5-(trifluoromethyl)pyridin-2-amine is CC(C)Nc1ccc(C(F)(F)F)cn1.
What is the InChIKey of N-propan-2-yl-5-(trifluoromethyl)pyridin-2-amine?
The InChIKey is XREHFRWADMHXHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11F3N2/c1-6(2)14-8-4-3-7(5-13-8)9(10,11)12/h3-6H,1-2H3,(H,13,14).
What are the key properties of N-propan-2-yl-5-(trifluoromethyl)pyridin-2-amine?
N-propan-2-yl-5-(trifluoromethyl)pyridin-2-amine has a molecular weight of 204.19 g/mol, XLogP of 2.92, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-5-(trifluoromethyl)pyridin-2-amine is sourced from PubChem (CID 2991704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).