2-[[8-chloro-3-pentyl-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]amino]-N-hydroxyacetamide

C15H18ClF3N4O2 — CID 141240841

IUPAC2-[[8-chloro-3-pentyl-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]amino]-N-hydroxyacetamide
SMILESCCCCCc1c(NCC(=O)NO)nc2c(Cl)cc(C(F)(F)F)cn12
InChIInChI=1S/C15H18ClF3N4O2/c1-2-3-4-5-11-13(20-7-12(24)22-25)21-14-10(16)6-9(8-23(11)14)15(17,18)19/h6,8,20,25H,2-5,7H2,1H3,(H,22,24)
InChIKeyFHIBTGFOQRAMQF-UHFFFAOYSA-N
MW378.78 g/mol
LogP3.66
Rot. Bonds7

About 2-[[8-chloro-3-pentyl-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]amino]-N-hydroxyacetamide

2-[[8-chloro-3-pentyl-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]amino]-N-hydroxyacetamide (PubChem CID 141240841) has the molecular formula C15H18ClF3N4O2 and a molecular weight of 378.78 g/mol. Its IUPAC name is 2-[[8-chloro-3-pentyl-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]amino]-N-hydroxyacetamide.

Molecular Properties

Compound Name2-[[8-chloro-3-pentyl-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]amino]-N-hydroxyacetamide
PubChem CID141240841
Molecular FormulaC15H18ClF3N4O2
Molecular Weight378.78 g/mol
Exact Mass378.11
IUPAC Name2-[[8-chloro-3-pentyl-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]amino]-N-hydroxyacetamide
SMILESCCCCCc1c(NCC(=O)NO)nc2c(Cl)cc(C(F)(F)F)cn12
InChIInChI=1S/C15H18ClF3N4O2/c1-2-3-4-5-11-13(20-7-12(24)22-25)21-14-10(16)6-9(8-23(11)14)15(17,18)19/h6,8,20,25H,2-5,7H2,1H3,(H,22,24)
InChIKeyFHIBTGFOQRAMQF-UHFFFAOYSA-N
XLogP3.66
TPSA78.66 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.78
LogP ≤ 53.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[[8-chloro-3-pentyl-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]amino]-N-hydroxyacetamide?
The IUPAC name of 2-[[8-chloro-3-pentyl-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]amino]-N-hydroxyacetamide (CID 141240841) is 2-[[8-chloro-3-pentyl-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]amino]-N-hydroxyacetamide.
What is the SMILES notation for 2-[[8-chloro-3-pentyl-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]amino]-N-hydroxyacetamide?
The canonical SMILES for 2-[[8-chloro-3-pentyl-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]amino]-N-hydroxyacetamide is CCCCCc1c(NCC(=O)NO)nc2c(Cl)cc(C(F)(F)F)cn12.
What is the InChIKey of 2-[[8-chloro-3-pentyl-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]amino]-N-hydroxyacetamide?
The InChIKey is FHIBTGFOQRAMQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18ClF3N4O2/c1-2-3-4-5-11-13(20-7-12(24)22-25)21-14-10(16)6-9(8-23(11)14)15(17,18)19/h6,8,20,25H,2-5,7H2,1H3,(H,22,24).
What are the key properties of 2-[[8-chloro-3-pentyl-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]amino]-N-hydroxyacetamide?
2-[[8-chloro-3-pentyl-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]amino]-N-hydroxyacetamide has a molecular weight of 378.78 g/mol, XLogP of 3.66, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[8-chloro-3-pentyl-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]amino]-N-hydroxyacetamide is sourced from PubChem (CID 141240841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).