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

C10H12BrN5O3 — CID 141239225

IUPAC2-[[8-amino-6-bromo-2-(hydroxymethyl)imidazo[1,2-a]pyridin-3-yl]amino]-N-hydroxyacetamide
SMILESNc1cc(Br)cn2c(NCC(=O)NO)c(CO)nc12
InChIInChI=1S/C10H12BrN5O3/c11-5-1-6(12)9-14-7(4-17)10(16(9)3-5)13-2-8(18)15-19/h1,3,13,17,19H,2,4,12H2,(H,15,18)
InChIKeyMEHUHTDKDNSPKS-UHFFFAOYSA-N
MW330.14 g/mol
LogP0.09
Rot. Bonds4

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

2-[[8-amino-6-bromo-2-(hydroxymethyl)imidazo[1,2-a]pyridin-3-yl]amino]-N-hydroxyacetamide (PubChem CID 141239225) has the molecular formula C10H12BrN5O3 and a molecular weight of 330.14 g/mol. Its IUPAC name is 2-[[8-amino-6-bromo-2-(hydroxymethyl)imidazo[1,2-a]pyridin-3-yl]amino]-N-hydroxyacetamide.

Molecular Properties

Compound Name2-[[8-amino-6-bromo-2-(hydroxymethyl)imidazo[1,2-a]pyridin-3-yl]amino]-N-hydroxyacetamide
PubChem CID141239225
Molecular FormulaC10H12BrN5O3
Molecular Weight330.14 g/mol
Exact Mass329.01
IUPAC Name2-[[8-amino-6-bromo-2-(hydroxymethyl)imidazo[1,2-a]pyridin-3-yl]amino]-N-hydroxyacetamide
SMILESNc1cc(Br)cn2c(NCC(=O)NO)c(CO)nc12
InChIInChI=1S/C10H12BrN5O3/c11-5-1-6(12)9-14-7(4-17)10(16(9)3-5)13-2-8(18)15-19/h1,3,13,17,19H,2,4,12H2,(H,15,18)
InChIKeyMEHUHTDKDNSPKS-UHFFFAOYSA-N
XLogP0.09
TPSA124.91 Ų
H-Bond Donors5
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.14
LogP ≤ 50.09
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 107

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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Related Compounds

2-[[8-amino-6-bromo-3-(2,2-dimethylpropyl)imidazo[1,2-a]pyridin-2-yl]amino]-N-hydroxyacetamide
CID 141241060
2-[[6-bromo-7,8-dimethyl-2-(2-methylpropyl)imidazo[1,2-a]pyridin-3-yl]amino]-N-hydroxyacetamide
CID 141239241
2-[(8-amino-6-chloro-3-propylimidazo[1,2-a]pyridin-2-yl)amino]-N-hydroxyacetamide
CID 141240791
2-[(6-bromo-2-tert-butylimidazo[1,2-a]pyridin-3-yl)amino]-N-hydroxyacetamide
CID 141239404
2-[(3-benzyl-6,8-dibromoimidazo[1,2-a]pyridin-2-yl)amino]-N-hydroxyacetamide
CID 141240795
2-[[2-(2,2-dimethylpropyl)-8-hydroxyimidazo[1,2-a]pyridin-3-yl]amino]-N-hydroxyacetamide
CID 141239196
3-[6,8-dibromo-3-[[2-(hydroxyamino)-2-oxoethyl]amino]-5,7-dimethylimidazo[1,2-a]pyridin-2-yl]propanoic acid
CID 141239433
2-[(6-bromo-2-butyl-5-methylimidazo[1,2-a]pyridin-3-yl)amino]-N-hydroxyacetamide
CID 141239208
3-[6-bromo-3-[[2-(hydroxyamino)-2-oxoethyl]amino]-5-methylimidazo[1,2-a]pyridin-2-yl]propanoic acid
CID 141239233
2-[[6,8-dibromo-5-methyl-3-(2-methylpropyl)imidazo[1,2-a]pyridin-2-yl]amino]-N-hydroxyacetamide
CID 141240784
6-bromo-3-ethylimidazo[1,2-a]pyridin-8-amine
CID 123565349
7-bromo-2-(hydroxymethyl)pyrido[1,2-a]pyrimidin-4-one
CID 16769119

Frequently Asked Questions

What is the IUPAC name of 2-[[8-amino-6-bromo-2-(hydroxymethyl)imidazo[1,2-a]pyridin-3-yl]amino]-N-hydroxyacetamide?
The IUPAC name of 2-[[8-amino-6-bromo-2-(hydroxymethyl)imidazo[1,2-a]pyridin-3-yl]amino]-N-hydroxyacetamide (CID 141239225) is 2-[[8-amino-6-bromo-2-(hydroxymethyl)imidazo[1,2-a]pyridin-3-yl]amino]-N-hydroxyacetamide.
What is the SMILES notation for 2-[[8-amino-6-bromo-2-(hydroxymethyl)imidazo[1,2-a]pyridin-3-yl]amino]-N-hydroxyacetamide?
The canonical SMILES for 2-[[8-amino-6-bromo-2-(hydroxymethyl)imidazo[1,2-a]pyridin-3-yl]amino]-N-hydroxyacetamide is Nc1cc(Br)cn2c(NCC(=O)NO)c(CO)nc12.
What is the InChIKey of 2-[[8-amino-6-bromo-2-(hydroxymethyl)imidazo[1,2-a]pyridin-3-yl]amino]-N-hydroxyacetamide?
The InChIKey is MEHUHTDKDNSPKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12BrN5O3/c11-5-1-6(12)9-14-7(4-17)10(16(9)3-5)13-2-8(18)15-19/h1,3,13,17,19H,2,4,12H2,(H,15,18).
What are the key properties of 2-[[8-amino-6-bromo-2-(hydroxymethyl)imidazo[1,2-a]pyridin-3-yl]amino]-N-hydroxyacetamide?
2-[[8-amino-6-bromo-2-(hydroxymethyl)imidazo[1,2-a]pyridin-3-yl]amino]-N-hydroxyacetamide has a molecular weight of 330.14 g/mol, XLogP of 0.09, 4 rotatable bonds, 5 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[8-amino-6-bromo-2-(hydroxymethyl)imidazo[1,2-a]pyridin-3-yl]amino]-N-hydroxyacetamide is sourced from PubChem (CID 141239225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).