2-[tert-butyl-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]amino]acetic acid

C15H21N3O2 — CID 79269294

IUPAC2-[tert-butyl-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]amino]acetic acid
SMILESCc1cccn2cc(CN(CC(=O)O)C(C)(C)C)nc12
InChIInChI=1S/C15H21N3O2/c1-11-6-5-7-17-8-12(16-14(11)17)9-18(10-13(19)20)15(2,3)4/h5-8H,9-10H2,1-4H3,(H,19,20)
InChIKeyLKNPEAWZCHORRC-UHFFFAOYSA-N
MW275.35 g/mol
LogP2.33
Rot. Bonds4

About 2-[tert-butyl-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]amino]acetic acid

2-[tert-butyl-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]amino]acetic acid (PubChem CID 79269294) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is 2-[tert-butyl-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]amino]acetic acid.

Molecular Properties

Compound Name2-[tert-butyl-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]amino]acetic acid
PubChem CID79269294
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC Name2-[tert-butyl-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]amino]acetic acid
SMILESCc1cccn2cc(CN(CC(=O)O)C(C)(C)C)nc12
InChIInChI=1S/C15H21N3O2/c1-11-6-5-7-17-8-12(16-14(11)17)9-18(10-13(19)20)15(2,3)4/h5-8H,9-10H2,1-4H3,(H,19,20)
InChIKeyLKNPEAWZCHORRC-UHFFFAOYSA-N
XLogP2.33
TPSA57.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[tert-butyl(imidazo[1,2-a]pyridin-2-ylmethyl)amino]acetic acid
CID 79268853
2-[2-(dimethylamino)ethyl-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]amino]acetic acid
CID 107425499
N,N-dimethyl-1-(8-methylimidazo[1,2-a]pyridin-2-yl)methanamine
CID 70660652
2-[2-hydroxyethyl-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]amino]ethanol
CID 60686544
3-[methyl-[2-(8-methylimidazo[1,2-a]pyridin-2-yl)acetyl]amino]propanoic acid
CID 39175642
3,3,3-trifluoro-2-methyl-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methylamino]propanoic acid
CID 79791356
(8-methylimidazo[1,2-a]pyridin-2-yl)methanamine;dihydrochloride
CID 50988319
(2S)-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]propanoic acid
CID 104876154
2,2-dimethyl-1-(8-methylimidazo[1,2-a]pyridin-2-yl)propan-1-one
CID 58252544
2,2-dimethyl-N'-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-N'-propylpropane-1,3-diamine
CID 79665478
6-[(8-methylimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]pyridine-3-carboxylic acid
CID 61304759
(2R)-2-amino-N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]propanamide
CID 119882775

Frequently Asked Questions

What is the IUPAC name of 2-[tert-butyl-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]amino]acetic acid?
The IUPAC name of 2-[tert-butyl-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]amino]acetic acid (CID 79269294) is 2-[tert-butyl-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]amino]acetic acid.
What is the SMILES notation for 2-[tert-butyl-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]amino]acetic acid?
The canonical SMILES for 2-[tert-butyl-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]amino]acetic acid is Cc1cccn2cc(CN(CC(=O)O)C(C)(C)C)nc12.
What is the InChIKey of 2-[tert-butyl-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]amino]acetic acid?
The InChIKey is LKNPEAWZCHORRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2/c1-11-6-5-7-17-8-12(16-14(11)17)9-18(10-13(19)20)15(2,3)4/h5-8H,9-10H2,1-4H3,(H,19,20).
What are the key properties of 2-[tert-butyl-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]amino]acetic acid?
2-[tert-butyl-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]amino]acetic acid has a molecular weight of 275.35 g/mol, XLogP of 2.33, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[tert-butyl-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]amino]acetic acid is sourced from PubChem (CID 79269294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).