2-[[8-amino-6-bromo-3-(2,2-dimethylpropyl)imidazo[1,2-a]pyridin-2-yl]amino]-N-hydroxyacetamide

C14H20BrN5O2 — CID 141241060

IUPAC2-[[8-amino-6-bromo-3-(2,2-dimethylpropyl)imidazo[1,2-a]pyridin-2-yl]amino]-N-hydroxyacetamide
SMILESCC(C)(C)Cc1c(NCC(=O)NO)nc2c(N)cc(Br)cn12
InChIInChI=1S/C14H20BrN5O2/c1-14(2,3)5-10-12(17-6-11(21)19-22)18-13-9(16)4-8(15)7-20(10)13/h4,7,17,22H,5-6,16H2,1-3H3,(H,19,21)
InChIKeyAEMHKTHOLMKFQR-UHFFFAOYSA-N
MW370.25 g/mol
LogP2.18
Rot. Bonds4

About 2-[[8-amino-6-bromo-3-(2,2-dimethylpropyl)imidazo[1,2-a]pyridin-2-yl]amino]-N-hydroxyacetamide

2-[[8-amino-6-bromo-3-(2,2-dimethylpropyl)imidazo[1,2-a]pyridin-2-yl]amino]-N-hydroxyacetamide (PubChem CID 141241060) has the molecular formula C14H20BrN5O2 and a molecular weight of 370.25 g/mol. Its IUPAC name is 2-[[8-amino-6-bromo-3-(2,2-dimethylpropyl)imidazo[1,2-a]pyridin-2-yl]amino]-N-hydroxyacetamide.

Molecular Properties

Compound Name2-[[8-amino-6-bromo-3-(2,2-dimethylpropyl)imidazo[1,2-a]pyridin-2-yl]amino]-N-hydroxyacetamide
PubChem CID141241060
Molecular FormulaC14H20BrN5O2
Molecular Weight370.25 g/mol
Exact Mass369.08
IUPAC Name2-[[8-amino-6-bromo-3-(2,2-dimethylpropyl)imidazo[1,2-a]pyridin-2-yl]amino]-N-hydroxyacetamide
SMILESCC(C)(C)Cc1c(NCC(=O)NO)nc2c(N)cc(Br)cn12
InChIInChI=1S/C14H20BrN5O2/c1-14(2,3)5-10-12(17-6-11(21)19-22)18-13-9(16)4-8(15)7-20(10)13/h4,7,17,22H,5-6,16H2,1-3H3,(H,19,21)
InChIKeyAEMHKTHOLMKFQR-UHFFFAOYSA-N
XLogP2.18
TPSA104.68 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.25
LogP ≤ 52.18
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'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-amino-6-bromo-3-(2,2-dimethylpropyl)imidazo[1,2-a]pyridin-2-yl]amino]-N-hydroxyacetamide?
The IUPAC name of 2-[[8-amino-6-bromo-3-(2,2-dimethylpropyl)imidazo[1,2-a]pyridin-2-yl]amino]-N-hydroxyacetamide (CID 141241060) is 2-[[8-amino-6-bromo-3-(2,2-dimethylpropyl)imidazo[1,2-a]pyridin-2-yl]amino]-N-hydroxyacetamide.
What is the SMILES notation for 2-[[8-amino-6-bromo-3-(2,2-dimethylpropyl)imidazo[1,2-a]pyridin-2-yl]amino]-N-hydroxyacetamide?
The canonical SMILES for 2-[[8-amino-6-bromo-3-(2,2-dimethylpropyl)imidazo[1,2-a]pyridin-2-yl]amino]-N-hydroxyacetamide is CC(C)(C)Cc1c(NCC(=O)NO)nc2c(N)cc(Br)cn12.
What is the InChIKey of 2-[[8-amino-6-bromo-3-(2,2-dimethylpropyl)imidazo[1,2-a]pyridin-2-yl]amino]-N-hydroxyacetamide?
The InChIKey is AEMHKTHOLMKFQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20BrN5O2/c1-14(2,3)5-10-12(17-6-11(21)19-22)18-13-9(16)4-8(15)7-20(10)13/h4,7,17,22H,5-6,16H2,1-3H3,(H,19,21).
What are the key properties of 2-[[8-amino-6-bromo-3-(2,2-dimethylpropyl)imidazo[1,2-a]pyridin-2-yl]amino]-N-hydroxyacetamide?
2-[[8-amino-6-bromo-3-(2,2-dimethylpropyl)imidazo[1,2-a]pyridin-2-yl]amino]-N-hydroxyacetamide has a molecular weight of 370.25 g/mol, XLogP of 2.18, 4 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[8-amino-6-bromo-3-(2,2-dimethylpropyl)imidazo[1,2-a]pyridin-2-yl]amino]-N-hydroxyacetamide is sourced from PubChem (CID 141241060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).