2-[1-(imidazo[1,2-a]pyridine-6-carbonylamino)cyclobutyl]acetic acid

C14H15N3O3 — CID 119217494

IUPAC2-[1-(imidazo[1,2-a]pyridine-6-carbonylamino)cyclobutyl]acetic acid
SMILESO=C(O)CC1(NC(=O)c2ccc3nccn3c2)CCC1
InChIInChI=1S/C14H15N3O3/c18-12(19)8-14(4-1-5-14)16-13(20)10-2-3-11-15-6-7-17(11)9-10/h2-3,6-7,9H,1,4-5,8H2,(H,16,20)(H,18,19)
InChIKeyHLWUAHUSGYGKLK-UHFFFAOYSA-N
MW273.29 g/mol
LogP1.46
Rot. Bonds4

About 2-[1-(imidazo[1,2-a]pyridine-6-carbonylamino)cyclobutyl]acetic acid

2-[1-(imidazo[1,2-a]pyridine-6-carbonylamino)cyclobutyl]acetic acid (PubChem CID 119217494) has the molecular formula C14H15N3O3 and a molecular weight of 273.29 g/mol. Its IUPAC name is 2-[1-(imidazo[1,2-a]pyridine-6-carbonylamino)cyclobutyl]acetic acid.

Molecular Properties

Compound Name2-[1-(imidazo[1,2-a]pyridine-6-carbonylamino)cyclobutyl]acetic acid
PubChem CID119217494
Molecular FormulaC14H15N3O3
Molecular Weight273.29 g/mol
Exact Mass273.11
IUPAC Name2-[1-(imidazo[1,2-a]pyridine-6-carbonylamino)cyclobutyl]acetic acid
SMILESO=C(O)CC1(NC(=O)c2ccc3nccn3c2)CCC1
InChIInChI=1S/C14H15N3O3/c18-12(19)8-14(4-1-5-14)16-13(20)10-2-3-11-15-6-7-17(11)9-10/h2-3,6-7,9H,1,4-5,8H2,(H,16,20)(H,18,19)
InChIKeyHLWUAHUSGYGKLK-UHFFFAOYSA-N
XLogP1.46
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 ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(aminomethyl)cyclopentyl]imidazo[1,2-a]pyridine-6-carboxamide;dihydrochloride
CID 119566109
1-(imidazo[1,2-a]pyridine-6-carbonylamino)cyclohexane-1-carboxylic acid
CID 119114103
2-[1-[[4-(aminomethyl)benzoyl]amino]cyclobutyl]acetic acid
CID 79845339
2-[1-[(4-chlorobenzoyl)amino]cyclobutyl]acetic acid
CID 79845388
2-[1-[(4-ethoxybenzoyl)amino]cyclobutyl]acetic acid
CID 79849172
N-(3-hydroxy-2,2-dimethylpropyl)imidazo[1,2-a]pyridine-6-carboxamide
CID 110475104
2-[1-[(4-iodobenzoyl)amino]cyclopentyl]acetic acid
CID 64672187
2-[1-[(2-bromopyridine-4-carbonyl)amino]cyclopentyl]acetic acid
CID 114037372
N-[2-(cycloheptylamino)ethyl]imidazo[1,2-a]pyridine-6-carboxamide;dihydrochloride
CID 119619984
2-[1-[(4-methylbenzoyl)amino]cyclohexyl]acetic acid
CID 64671347
2-[1-[(3-methylpyridine-2-carbonyl)amino]cyclopentyl]acetic acid
CID 64671017
N-(3-phenylpropyl)imidazo[1,2-a]pyridine-6-carboxamide
CID 110704012

Frequently Asked Questions

What is the IUPAC name of 2-[1-(imidazo[1,2-a]pyridine-6-carbonylamino)cyclobutyl]acetic acid?
The IUPAC name of 2-[1-(imidazo[1,2-a]pyridine-6-carbonylamino)cyclobutyl]acetic acid (CID 119217494) is 2-[1-(imidazo[1,2-a]pyridine-6-carbonylamino)cyclobutyl]acetic acid.
What is the SMILES notation for 2-[1-(imidazo[1,2-a]pyridine-6-carbonylamino)cyclobutyl]acetic acid?
The canonical SMILES for 2-[1-(imidazo[1,2-a]pyridine-6-carbonylamino)cyclobutyl]acetic acid is O=C(O)CC1(NC(=O)c2ccc3nccn3c2)CCC1.
What is the InChIKey of 2-[1-(imidazo[1,2-a]pyridine-6-carbonylamino)cyclobutyl]acetic acid?
The InChIKey is HLWUAHUSGYGKLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O3/c18-12(19)8-14(4-1-5-14)16-13(20)10-2-3-11-15-6-7-17(11)9-10/h2-3,6-7,9H,1,4-5,8H2,(H,16,20)(H,18,19).
What are the key properties of 2-[1-(imidazo[1,2-a]pyridine-6-carbonylamino)cyclobutyl]acetic acid?
2-[1-(imidazo[1,2-a]pyridine-6-carbonylamino)cyclobutyl]acetic acid has a molecular weight of 273.29 g/mol, XLogP of 1.46, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(imidazo[1,2-a]pyridine-6-carbonylamino)cyclobutyl]acetic acid is sourced from PubChem (CID 119217494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).