2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)acetic acid;hydrobromide

C9H13BrN2O2 — CID 170911040

IUPAC2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)acetic acid;hydrobromide
SMILESBr.O=C(O)Cc1cn2c(n1)CCCC2
InChIInChI=1S/C9H12N2O2.BrH/c12-9(13)5-7-6-11-4-2-1-3-8(11)10-7;/h6H,1-5H2,(H,12,13);1H
InChIKeyNOOBOFGCJJIKDC-UHFFFAOYSA-N
MW261.12 g/mol
LogP1.42
Rot. Bonds2

About 2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)acetic acid;hydrobromide

2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)acetic acid;hydrobromide (PubChem CID 170911040) has the molecular formula C9H13BrN2O2 and a molecular weight of 261.12 g/mol. Its IUPAC name is 2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)acetic acid;hydrobromide.

Molecular Properties

Compound Name2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)acetic acid;hydrobromide
PubChem CID170911040
Molecular FormulaC9H13BrN2O2
Molecular Weight261.12 g/mol
Exact Mass260.02
IUPAC Name2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)acetic acid;hydrobromide
SMILESBr.O=C(O)Cc1cn2c(n1)CCCC2
InChIInChI=1S/C9H12N2O2.BrH/c12-9(13)5-7-6-11-4-2-1-3-8(11)10-7;/h6H,1-5H2,(H,12,13);1H
InChIKeyNOOBOFGCJJIKDC-UHFFFAOYSA-N
XLogP1.42
TPSA55.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.12
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-Methylimidazoleacetic acid
CID 75810
1-Methylimidazole-5-acetic acid
CID 6451814
1-methyl-1H-imidazol-4-acetic acid monohydrochloride
CID 16219703
2-{5H,6H,7H,8H-imidazo[1,2-a]pyridin-2-yl}ethan-1-ol
CID 67473277
1-Methyl-4-imidazoleacetate
CID 21283465
2-[(5R,6R,7S,8S)-6,7,8-trihydroxy-5-(hydroxymethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]acetic acid
CID 11402658
2-(1-methyl-1H-imidazol-5-yl)acetic acid hydrochloride
CID 69892609
5H,6H,7H,8H-imidazo[1,5-a]pyridine-8-carboxylic acid
CID 82414298
2-{5H,6H,7H,8H-imidazo[1,2-a]pyridin-2-yl}acetic acid hydrochloride
CID 122156770
2-(8-methyl-5H,6H,7H,8H-imidazo(1,2-a)pyridin-3-yl)acetic acid hydrochloride
CID 132371662
methyl 2-{5H,6H,7H,8H-imidazo[1,2-a]pyrimidin-3-yl}acetate
CID 137217184
2-ethyl-5H,6H,7H,8H-imidazo(1,2-a)pyridine-7-carboxylic acid hydrochloride
CID 137943618

Frequently Asked Questions

What is the IUPAC name of 2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)acetic acid;hydrobromide?
The IUPAC name of 2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)acetic acid;hydrobromide (CID 170911040) is 2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)acetic acid;hydrobromide.
What is the SMILES notation for 2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)acetic acid;hydrobromide?
The canonical SMILES for 2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)acetic acid;hydrobromide is Br.O=C(O)Cc1cn2c(n1)CCCC2.
What is the InChIKey of 2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)acetic acid;hydrobromide?
The InChIKey is NOOBOFGCJJIKDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O2.BrH/c12-9(13)5-7-6-11-4-2-1-3-8(11)10-7;/h6H,1-5H2,(H,12,13);1H.
What are the key properties of 2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)acetic acid;hydrobromide?
2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)acetic acid;hydrobromide has a molecular weight of 261.12 g/mol, XLogP of 1.42, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)acetic acid;hydrobromide is sourced from PubChem (CID 170911040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).