3-[1-(trifluoromethyl)cyclopropyl]imidazo[4,5-b]pyridin-2-amine

C10H9F3N4 — CID 106216819

IUPAC3-[1-(trifluoromethyl)cyclopropyl]imidazo[4,5-b]pyridin-2-amine
SMILESNc1nc2cccnc2n1C1(C(F)(F)F)CC1
InChIInChI=1S/C10H9F3N4/c11-10(12,13)9(3-4-9)17-7-6(16-8(17)14)2-1-5-15-7/h1-2,5H,3-4H2,(H2,14,16)
InChIKeyYZLFAKAJJDLNAO-UHFFFAOYSA-N
MW242.20 g/mol
LogP2.06
Rot. Bonds1

About 3-[1-(trifluoromethyl)cyclopropyl]imidazo[4,5-b]pyridin-2-amine

3-[1-(trifluoromethyl)cyclopropyl]imidazo[4,5-b]pyridin-2-amine (PubChem CID 106216819) has the molecular formula C10H9F3N4 and a molecular weight of 242.20 g/mol. Its IUPAC name is 3-[1-(trifluoromethyl)cyclopropyl]imidazo[4,5-b]pyridin-2-amine.

Molecular Properties

Compound Name3-[1-(trifluoromethyl)cyclopropyl]imidazo[4,5-b]pyridin-2-amine
PubChem CID106216819
Molecular FormulaC10H9F3N4
Molecular Weight242.20 g/mol
Exact Mass242.08
IUPAC Name3-[1-(trifluoromethyl)cyclopropyl]imidazo[4,5-b]pyridin-2-amine
SMILESNc1nc2cccnc2n1C1(C(F)(F)F)CC1
InChIInChI=1S/C10H9F3N4/c11-10(12,13)9(3-4-9)17-7-6(16-8(17)14)2-1-5-15-7/h1-2,5H,3-4H2,(H2,14,16)
InChIKeyYZLFAKAJJDLNAO-UHFFFAOYSA-N
XLogP2.06
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.20
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-chloro-1-[1-(trifluoromethyl)cyclopropyl]benzimidazol-2-amine
CID 106216801
5,6-dimethoxy-1-[1-(trifluoromethyl)cyclopropyl]benzimidazol-2-amine
CID 106216828
3-(3,4-difluorophenyl)imidazo[4,5-b]pyridin-2-amine
CID 79289903
3-benzylimidazo[4,5-b]pyridin-2-amine
CID 79289249
3-(3,3-dimethylbutan-2-yl)imidazo[4,5-b]pyridin-2-amine
CID 104828995
3-cyclobutylimidazo[4,5-b]pyridin-2-amine
CID 79289020
3-(cyclohexylmethyl)imidazo[4,5-b]pyridin-2-amine
CID 79289426
3-(3-methylbutyl)imidazo[4,5-b]pyridin-2-amine
CID 79289500
3-pentan-3-ylimidazo[4,5-b]pyridin-2-amine
CID 79290142
3-[(3-fluorophenyl)methyl]imidazo[4,5-b]pyridin-2-amine
CID 79289581
7-methyl-3-[1-(trifluoromethyl)cyclopropyl]-1H-imidazo[4,5-b]pyridine-2-thione
CID 106215202
3-(1,3-thiazol-2-ylmethyl)imidazo[4,5-b]pyridin-2-amine
CID 79290074

Frequently Asked Questions

What is the IUPAC name of 3-[1-(trifluoromethyl)cyclopropyl]imidazo[4,5-b]pyridin-2-amine?
The IUPAC name of 3-[1-(trifluoromethyl)cyclopropyl]imidazo[4,5-b]pyridin-2-amine (CID 106216819) is 3-[1-(trifluoromethyl)cyclopropyl]imidazo[4,5-b]pyridin-2-amine.
What is the SMILES notation for 3-[1-(trifluoromethyl)cyclopropyl]imidazo[4,5-b]pyridin-2-amine?
The canonical SMILES for 3-[1-(trifluoromethyl)cyclopropyl]imidazo[4,5-b]pyridin-2-amine is Nc1nc2cccnc2n1C1(C(F)(F)F)CC1.
What is the InChIKey of 3-[1-(trifluoromethyl)cyclopropyl]imidazo[4,5-b]pyridin-2-amine?
The InChIKey is YZLFAKAJJDLNAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9F3N4/c11-10(12,13)9(3-4-9)17-7-6(16-8(17)14)2-1-5-15-7/h1-2,5H,3-4H2,(H2,14,16).
What are the key properties of 3-[1-(trifluoromethyl)cyclopropyl]imidazo[4,5-b]pyridin-2-amine?
3-[1-(trifluoromethyl)cyclopropyl]imidazo[4,5-b]pyridin-2-amine has a molecular weight of 242.20 g/mol, XLogP of 2.06, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(trifluoromethyl)cyclopropyl]imidazo[4,5-b]pyridin-2-amine is sourced from PubChem (CID 106216819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).