1-[(imidazo[1,2-a]pyridine-2-carbonylamino)methyl]cyclobutane-1-carboxylic acid

C14H15N3O3 — CID 81362941

IUPAC1-[(imidazo[1,2-a]pyridine-2-carbonylamino)methyl]cyclobutane-1-carboxylic acid
SMILESO=C(NCC1(C(=O)O)CCC1)c1cn2ccccc2n1
InChIInChI=1S/C14H15N3O3/c18-12(15-9-14(13(19)20)5-3-6-14)10-8-17-7-2-1-4-11(17)16-10/h1-2,4,7-8H,3,5-6,9H2,(H,15,18)(H,19,20)
InChIKeyANTFFOMOLZOZPX-UHFFFAOYSA-N
MW273.29 g/mol
LogP1.32
Rot. Bonds4

About 1-[(imidazo[1,2-a]pyridine-2-carbonylamino)methyl]cyclobutane-1-carboxylic acid

1-[(imidazo[1,2-a]pyridine-2-carbonylamino)methyl]cyclobutane-1-carboxylic acid (PubChem CID 81362941) has the molecular formula C14H15N3O3 and a molecular weight of 273.29 g/mol. Its IUPAC name is 1-[(imidazo[1,2-a]pyridine-2-carbonylamino)methyl]cyclobutane-1-carboxylic acid.

Molecular Properties

Compound Name1-[(imidazo[1,2-a]pyridine-2-carbonylamino)methyl]cyclobutane-1-carboxylic acid
PubChem CID81362941
Molecular FormulaC14H15N3O3
Molecular Weight273.29 g/mol
Exact Mass273.11
IUPAC Name1-[(imidazo[1,2-a]pyridine-2-carbonylamino)methyl]cyclobutane-1-carboxylic acid
SMILESO=C(NCC1(C(=O)O)CCC1)c1cn2ccccc2n1
InChIInChI=1S/C14H15N3O3/c18-12(15-9-14(13(19)20)5-3-6-14)10-8-17-7-2-1-4-11(17)16-10/h1-2,4,7-8H,3,5-6,9H2,(H,15,18)(H,19,20)
InChIKeyANTFFOMOLZOZPX-UHFFFAOYSA-N
XLogP1.32
TPSA83.70 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.29
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(4-carbamoyloxan-4-yl)methyl]imidazo[1,2-a]pyridine-2-carboxamide
CID 56817800
1-[[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]methyl]cyclobutane-1-carboxylic acid
CID 81369818
N-(aminomethyl)imidazo[1,2-a]pyridine-2-carboxamide
CID 66612183
N-[(1-hydroxy-4-methylcyclohexyl)methyl]imidazo[1,2-a]pyridine-2-carboxamide
CID 65119667
N-[(3-hydroxycyclobutyl)methyl]imidazo[1,2-a]pyridine-2-carboxamide
CID 66005188
N-(2-methoxyethyl)imidazo[1,2-a]pyridine-2-carboxamide
CID 51253266
N-[2-[(1R,2R)-2-hydroxycyclohexyl]ethyl]imidazo[1,2-a]pyridine-2-carboxamide
CID 136587148
N-[[(2S)-oxolan-2-yl]methyl]imidazo[1,2-a]pyridine-2-carboxamide
CID 94184886
N-[(4-hydroxypyrrolidin-3-yl)methyl]imidazo[1,2-a]pyridine-2-carboxamide;dihydrochloride
CID 120946954
1-[(pyrazolo[1,5-a]pyridine-3-carbonylamino)methyl]cyclopentane-1-carboxylic acid
CID 103791309
3-(imidazo[1,2-a]pyridine-2-carbonylamino)-2-methoxypropanoic acid
CID 106107683
N-[2-(cyclohexen-1-yl)ethyl]imidazo[1,2-a]pyridine-2-carboxamide
CID 87051260

Frequently Asked Questions

What is the IUPAC name of 1-[(imidazo[1,2-a]pyridine-2-carbonylamino)methyl]cyclobutane-1-carboxylic acid?
The IUPAC name of 1-[(imidazo[1,2-a]pyridine-2-carbonylamino)methyl]cyclobutane-1-carboxylic acid (CID 81362941) is 1-[(imidazo[1,2-a]pyridine-2-carbonylamino)methyl]cyclobutane-1-carboxylic acid.
What is the SMILES notation for 1-[(imidazo[1,2-a]pyridine-2-carbonylamino)methyl]cyclobutane-1-carboxylic acid?
The canonical SMILES for 1-[(imidazo[1,2-a]pyridine-2-carbonylamino)methyl]cyclobutane-1-carboxylic acid is O=C(NCC1(C(=O)O)CCC1)c1cn2ccccc2n1.
What is the InChIKey of 1-[(imidazo[1,2-a]pyridine-2-carbonylamino)methyl]cyclobutane-1-carboxylic acid?
The InChIKey is ANTFFOMOLZOZPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O3/c18-12(15-9-14(13(19)20)5-3-6-14)10-8-17-7-2-1-4-11(17)16-10/h1-2,4,7-8H,3,5-6,9H2,(H,15,18)(H,19,20).
What are the key properties of 1-[(imidazo[1,2-a]pyridine-2-carbonylamino)methyl]cyclobutane-1-carboxylic acid?
1-[(imidazo[1,2-a]pyridine-2-carbonylamino)methyl]cyclobutane-1-carboxylic acid has a molecular weight of 273.29 g/mol, XLogP of 1.32, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(imidazo[1,2-a]pyridine-2-carbonylamino)methyl]cyclobutane-1-carboxylic acid is sourced from PubChem (CID 81362941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).