2-[tert-butyl(imidazo[1,2-a]pyridin-2-ylmethyl)amino]acetic acid

C14H19N3O2 — CID 79268853

IUPAC2-[tert-butyl(imidazo[1,2-a]pyridin-2-ylmethyl)amino]acetic acid
SMILESCC(C)(C)N(CC(=O)O)Cc1cn2ccccc2n1
InChIInChI=1S/C14H19N3O2/c1-14(2,3)17(10-13(18)19)9-11-8-16-7-5-4-6-12(16)15-11/h4-8H,9-10H2,1-3H3,(H,18,19)
InChIKeySRGBTADRELKAAB-UHFFFAOYSA-N
MW261.32 g/mol
LogP2.02
Rot. Bonds4

About 2-[tert-butyl(imidazo[1,2-a]pyridin-2-ylmethyl)amino]acetic acid

2-[tert-butyl(imidazo[1,2-a]pyridin-2-ylmethyl)amino]acetic acid (PubChem CID 79268853) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is 2-[tert-butyl(imidazo[1,2-a]pyridin-2-ylmethyl)amino]acetic acid.

Molecular Properties

Compound Name2-[tert-butyl(imidazo[1,2-a]pyridin-2-ylmethyl)amino]acetic acid
PubChem CID79268853
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC Name2-[tert-butyl(imidazo[1,2-a]pyridin-2-ylmethyl)amino]acetic acid
SMILESCC(C)(C)N(CC(=O)O)Cc1cn2ccccc2n1
InChIInChI=1S/C14H19N3O2/c1-14(2,3)17(10-13(18)19)9-11-8-16-7-5-4-6-12(16)15-11/h4-8H,9-10H2,1-3H3,(H,18,19)
InChIKeySRGBTADRELKAAB-UHFFFAOYSA-N
XLogP2.02
TPSA57.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[ethyl(imidazo[1,2-a]pyridin-2-ylmethyl)amino]acetic acid
CID 54900006
2-[tert-butyl-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]amino]acetic acid
CID 79269294
2-[2-(dimethylamino)ethyl-(imidazo[1,2-a]pyridin-2-ylmethyl)amino]acetic acid
CID 107425654
2-N-ethyl-2-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-methylpropane-1,2-diamine
CID 62010368
3-[imidazo[1,2-a]pyridin-2-ylmethyl(propan-2-yl)amino]propanoic acid
CID 60839321
N-ethyl-N-(imidazo[1,2-a]pyridin-2-ylmethyl)ethanamine
CID 4701920
2-(2,2-dimethylpropyl)imidazo[1,2-a]pyridine
CID 59380864
ethane;imidazo[1,2-a]pyridin-2-ylmethanol
CID 91126513
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-methylpropan-2-amine
CID 28586618
N-[4-[bis(imidazo[1,2-a]pyridin-2-ylmethyl)amino]phenyl]acetamide
CID 3400889
2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]acetic acid
CID 43170541
2-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-N,2-dimethylbutane-1,2-diamine
CID 62009772

Frequently Asked Questions

What is the IUPAC name of 2-[tert-butyl(imidazo[1,2-a]pyridin-2-ylmethyl)amino]acetic acid?
The IUPAC name of 2-[tert-butyl(imidazo[1,2-a]pyridin-2-ylmethyl)amino]acetic acid (CID 79268853) is 2-[tert-butyl(imidazo[1,2-a]pyridin-2-ylmethyl)amino]acetic acid.
What is the SMILES notation for 2-[tert-butyl(imidazo[1,2-a]pyridin-2-ylmethyl)amino]acetic acid?
The canonical SMILES for 2-[tert-butyl(imidazo[1,2-a]pyridin-2-ylmethyl)amino]acetic acid is CC(C)(C)N(CC(=O)O)Cc1cn2ccccc2n1.
What is the InChIKey of 2-[tert-butyl(imidazo[1,2-a]pyridin-2-ylmethyl)amino]acetic acid?
The InChIKey is SRGBTADRELKAAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c1-14(2,3)17(10-13(18)19)9-11-8-16-7-5-4-6-12(16)15-11/h4-8H,9-10H2,1-3H3,(H,18,19).
What are the key properties of 2-[tert-butyl(imidazo[1,2-a]pyridin-2-ylmethyl)amino]acetic acid?
2-[tert-butyl(imidazo[1,2-a]pyridin-2-ylmethyl)amino]acetic acid has a molecular weight of 261.32 g/mol, XLogP of 2.02, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[tert-butyl(imidazo[1,2-a]pyridin-2-ylmethyl)amino]acetic acid is sourced from PubChem (CID 79268853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).