2-[2-(dimethylamino)ethyl-(imidazo[1,2-a]pyridin-2-ylmethyl)amino]acetic acid

C14H20N4O2 — CID 107425654

IUPAC2-[2-(dimethylamino)ethyl-(imidazo[1,2-a]pyridin-2-ylmethyl)amino]acetic acid
SMILESCN(C)CCN(CC(=O)O)Cc1cn2ccccc2n1
InChIInChI=1S/C14H20N4O2/c1-16(2)7-8-17(11-14(19)20)9-12-10-18-6-4-3-5-13(18)15-12/h3-6,10H,7-9,11H2,1-2H3,(H,19,20)
InChIKeyZTFAETOPCYTJPU-UHFFFAOYSA-N
MW276.34 g/mol
LogP0.78
Rot. Bonds7

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

2-[2-(dimethylamino)ethyl-(imidazo[1,2-a]pyridin-2-ylmethyl)amino]acetic acid (PubChem CID 107425654) has the molecular formula C14H20N4O2 and a molecular weight of 276.34 g/mol. Its IUPAC name is 2-[2-(dimethylamino)ethyl-(imidazo[1,2-a]pyridin-2-ylmethyl)amino]acetic acid.

Molecular Properties

Compound Name2-[2-(dimethylamino)ethyl-(imidazo[1,2-a]pyridin-2-ylmethyl)amino]acetic acid
PubChem CID107425654
Molecular FormulaC14H20N4O2
Molecular Weight276.34 g/mol
Exact Mass276.16
IUPAC Name2-[2-(dimethylamino)ethyl-(imidazo[1,2-a]pyridin-2-ylmethyl)amino]acetic acid
SMILESCN(C)CCN(CC(=O)O)Cc1cn2ccccc2n1
InChIInChI=1S/C14H20N4O2/c1-16(2)7-8-17(11-14(19)20)9-12-10-18-6-4-3-5-13(18)15-12/h3-6,10H,7-9,11H2,1-2H3,(H,19,20)
InChIKeyZTFAETOPCYTJPU-UHFFFAOYSA-N
XLogP0.78
TPSA61.08 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[ethyl(imidazo[1,2-a]pyridin-2-ylmethyl)amino]acetic acid
CID 54900006
2-[2-(dimethylamino)ethyl-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]amino]acetic acid
CID 107425499
2-[tert-butyl(imidazo[1,2-a]pyridin-2-ylmethyl)amino]acetic acid
CID 79268853
N-ethyl-N-(imidazo[1,2-a]pyridin-2-ylmethyl)ethanamine
CID 4701920
3-[imidazo[1,2-a]pyridin-2-ylmethyl(propan-2-yl)amino]propanoic acid
CID 60839321
2-chloro-N-ethyl-N-(imidazo[1,2-a]pyridin-2-ylmethyl)ethanamine
CID 63387084
3-[imidazo[1,2-a]pyridin-2-ylmethyl(methyl)amino]propanimidamide
CID 43186266
N'-ethyl-N'-(imidazo[1,2-a]pyridin-2-ylmethyl)propane-1,3-diamine
CID 43137193
ethane;imidazo[1,2-a]pyridin-2-ylmethanol
CID 91126513
N-[4-[bis(imidazo[1,2-a]pyridin-2-ylmethyl)amino]phenyl]acetamide
CID 3400889
3-[ethyl-(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]-2-methylpropanoic acid
CID 62825599
1-[N-(imidazo[1,2-a]pyridin-2-ylmethyl)anilino]butan-2-ol
CID 110931014

Frequently Asked Questions

What is the IUPAC name of 2-[2-(dimethylamino)ethyl-(imidazo[1,2-a]pyridin-2-ylmethyl)amino]acetic acid?
The IUPAC name of 2-[2-(dimethylamino)ethyl-(imidazo[1,2-a]pyridin-2-ylmethyl)amino]acetic acid (CID 107425654) is 2-[2-(dimethylamino)ethyl-(imidazo[1,2-a]pyridin-2-ylmethyl)amino]acetic acid.
What is the SMILES notation for 2-[2-(dimethylamino)ethyl-(imidazo[1,2-a]pyridin-2-ylmethyl)amino]acetic acid?
The canonical SMILES for 2-[2-(dimethylamino)ethyl-(imidazo[1,2-a]pyridin-2-ylmethyl)amino]acetic acid is CN(C)CCN(CC(=O)O)Cc1cn2ccccc2n1.
What is the InChIKey of 2-[2-(dimethylamino)ethyl-(imidazo[1,2-a]pyridin-2-ylmethyl)amino]acetic acid?
The InChIKey is ZTFAETOPCYTJPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O2/c1-16(2)7-8-17(11-14(19)20)9-12-10-18-6-4-3-5-13(18)15-12/h3-6,10H,7-9,11H2,1-2H3,(H,19,20).
What are the key properties of 2-[2-(dimethylamino)ethyl-(imidazo[1,2-a]pyridin-2-ylmethyl)amino]acetic acid?
2-[2-(dimethylamino)ethyl-(imidazo[1,2-a]pyridin-2-ylmethyl)amino]acetic acid has a molecular weight of 276.34 g/mol, XLogP of 0.78, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(dimethylamino)ethyl-(imidazo[1,2-a]pyridin-2-ylmethyl)amino]acetic acid is sourced from PubChem (CID 107425654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).