1,1,1-trifluoro-2-(1H-imidazo[4,5-b]pyridin-2-yl)propan-2-amine

C9H9F3N4 — CID 79798723

IUPAC1,1,1-trifluoro-2-(1H-imidazo[4,5-b]pyridin-2-yl)propan-2-amine
SMILESCC(N)(c1nc2ncccc2[nH]1)C(F)(F)F
InChIInChI=1S/C9H9F3N4/c1-8(13,9(10,11)12)7-15-5-3-2-4-14-6(5)16-7/h2-4H,13H2,1H3,(H,14,15,16)
InChIKeyUJLCZRYXZCRYQD-UHFFFAOYSA-N
MW230.19 g/mol
LogP1.69
Rot. Bonds1

About 1,1,1-trifluoro-2-(1H-imidazo[4,5-b]pyridin-2-yl)propan-2-amine

1,1,1-trifluoro-2-(1H-imidazo[4,5-b]pyridin-2-yl)propan-2-amine (PubChem CID 79798723) has the molecular formula C9H9F3N4 and a molecular weight of 230.19 g/mol. Its IUPAC name is 1,1,1-trifluoro-2-(1H-imidazo[4,5-b]pyridin-2-yl)propan-2-amine.

Molecular Properties

Compound Name1,1,1-trifluoro-2-(1H-imidazo[4,5-b]pyridin-2-yl)propan-2-amine
PubChem CID79798723
Molecular FormulaC9H9F3N4
Molecular Weight230.19 g/mol
Exact Mass230.08
IUPAC Name1,1,1-trifluoro-2-(1H-imidazo[4,5-b]pyridin-2-yl)propan-2-amine
SMILESCC(N)(c1nc2ncccc2[nH]1)C(F)(F)F
InChIInChI=1S/C9H9F3N4/c1-8(13,9(10,11)12)7-15-5-3-2-4-14-6(5)16-7/h2-4H,13H2,1H3,(H,14,15,16)
InChIKeyUJLCZRYXZCRYQD-UHFFFAOYSA-N
XLogP1.69
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.19
LogP ≤ 51.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1,1,2,2,2-pentafluoroethyl)-1H-imidazo[4,5-b]pyridine
CID 10105558
2-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)-1,1,1-trifluoropropan-2-amine
CID 79815424
2-(1,1,1,3,3,3-hexafluoropropan-2-yl)-1H-imidazo[4,5-b]pyridine
CID 103310076
2-(5,6-difluoro-1H-benzimidazol-2-yl)-1,1,1-trifluoropropan-2-amine
CID 79798993
2-(5,6-dimethyl-1H-benzimidazol-2-yl)-1,1,1-trifluoropropan-2-amine
CID 79798998
1H-imidazo[4,5-b]pyridin-2-amine;hydrate;tetrahydrochloride
CID 141030571
2-(2-fluoropropan-2-yl)-1H-imidazo[4,5-b]pyridin-5-amine
CID 127016339
CID 59368109
CID 59368109
2-(4,6-difluoro-1H-benzimidazol-2-yl)-1,1,1-trifluoropropan-2-amine
CID 81450045
2-ethoxy-1H-imidazo[4,5-b]pyridine
CID 69016773
1H-imidazo[4,5-b]pyridine-2-carbothioamide
CID 86130577
2-amino-6-(1H-imidazo[4,5-b]pyridin-2-yl)phenol
CID 136712580

Frequently Asked Questions

What is the IUPAC name of 1,1,1-trifluoro-2-(1H-imidazo[4,5-b]pyridin-2-yl)propan-2-amine?
The IUPAC name of 1,1,1-trifluoro-2-(1H-imidazo[4,5-b]pyridin-2-yl)propan-2-amine (CID 79798723) is 1,1,1-trifluoro-2-(1H-imidazo[4,5-b]pyridin-2-yl)propan-2-amine.
What is the SMILES notation for 1,1,1-trifluoro-2-(1H-imidazo[4,5-b]pyridin-2-yl)propan-2-amine?
The canonical SMILES for 1,1,1-trifluoro-2-(1H-imidazo[4,5-b]pyridin-2-yl)propan-2-amine is CC(N)(c1nc2ncccc2[nH]1)C(F)(F)F.
What is the InChIKey of 1,1,1-trifluoro-2-(1H-imidazo[4,5-b]pyridin-2-yl)propan-2-amine?
The InChIKey is UJLCZRYXZCRYQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9F3N4/c1-8(13,9(10,11)12)7-15-5-3-2-4-14-6(5)16-7/h2-4H,13H2,1H3,(H,14,15,16).
What are the key properties of 1,1,1-trifluoro-2-(1H-imidazo[4,5-b]pyridin-2-yl)propan-2-amine?
1,1,1-trifluoro-2-(1H-imidazo[4,5-b]pyridin-2-yl)propan-2-amine has a molecular weight of 230.19 g/mol, XLogP of 1.69, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,1-trifluoro-2-(1H-imidazo[4,5-b]pyridin-2-yl)propan-2-amine is sourced from PubChem (CID 79798723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).