1-[[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]methyl]cyclobutane-1-carboxylic acid

C15H17N3O3 — CID 81369818

IUPAC1-[[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]methyl]cyclobutane-1-carboxylic acid
SMILESCc1cccc2nc(C(=O)NCC3(C(=O)O)CCC3)cn12
InChIInChI=1S/C15H17N3O3/c1-10-4-2-5-12-17-11(8-18(10)12)13(19)16-9-15(14(20)21)6-3-7-15/h2,4-5,8H,3,6-7,9H2,1H3,(H,16,19)(H,20,21)
InChIKeyTYCVNNVZRUTUNH-UHFFFAOYSA-N
MW287.32 g/mol
LogP1.63
Rot. Bonds4

About 1-[[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]methyl]cyclobutane-1-carboxylic acid

1-[[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]methyl]cyclobutane-1-carboxylic acid (PubChem CID 81369818) has the molecular formula C15H17N3O3 and a molecular weight of 287.32 g/mol. Its IUPAC name is 1-[[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]methyl]cyclobutane-1-carboxylic acid.

Molecular Properties

Compound Name1-[[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]methyl]cyclobutane-1-carboxylic acid
PubChem CID81369818
Molecular FormulaC15H17N3O3
Molecular Weight287.32 g/mol
Exact Mass287.13
IUPAC Name1-[[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]methyl]cyclobutane-1-carboxylic acid
SMILESCc1cccc2nc(C(=O)NCC3(C(=O)O)CCC3)cn12
InChIInChI=1S/C15H17N3O3/c1-10-4-2-5-12-17-11(8-18(10)12)13(19)16-9-15(14(20)21)6-3-7-15/h2,4-5,8H,3,6-7,9H2,1H3,(H,16,19)(H,20,21)
InChIKeyTYCVNNVZRUTUNH-UHFFFAOYSA-N
XLogP1.63
TPSA83.70 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.32
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1-hydroxycyclobutyl)methyl]-5-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 115643362
1-[(imidazo[1,2-a]pyridine-2-carbonylamino)methyl]cyclobutane-1-carboxylic acid
CID 81362941
5-methyl-N-[(1-pyridin-2-ylcyclopropyl)methyl]imidazo[1,2-a]pyridine-2-carboxamide
CID 86815537
5-methylimidazo[1,2-a]pyridine-2-carbohydrazide
CID 43236612
2-[[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]methyl]cyclopentane-1-carboxylic acid
CID 166178692
N-(3-acetamidophenyl)-5-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 26114454
1-[[(2,6-dimethylbenzoyl)amino]methyl]cyclobutane-1-carboxylic acid
CID 113352844
N-[3-(hydroxymethyl)phenyl]-5-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 60630109
N-(1,3-dihydroxypropan-2-yl)-5-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 65314901
N-(5-hydroxy-2,2-dimethylpentyl)-5-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 103900041
1-[[(5-methylpyrazine-2-carbonyl)amino]methyl]cyclobutane-1-carboxylic acid
CID 81362499
methyl 3-hydroxy-2-[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]propanoate
CID 43408753

Frequently Asked Questions

What is the IUPAC name of 1-[[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]methyl]cyclobutane-1-carboxylic acid?
The IUPAC name of 1-[[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]methyl]cyclobutane-1-carboxylic acid (CID 81369818) is 1-[[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]methyl]cyclobutane-1-carboxylic acid.
What is the SMILES notation for 1-[[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]methyl]cyclobutane-1-carboxylic acid?
The canonical SMILES for 1-[[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]methyl]cyclobutane-1-carboxylic acid is Cc1cccc2nc(C(=O)NCC3(C(=O)O)CCC3)cn12.
What is the InChIKey of 1-[[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]methyl]cyclobutane-1-carboxylic acid?
The InChIKey is TYCVNNVZRUTUNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O3/c1-10-4-2-5-12-17-11(8-18(10)12)13(19)16-9-15(14(20)21)6-3-7-15/h2,4-5,8H,3,6-7,9H2,1H3,(H,16,19)(H,20,21).
What are the key properties of 1-[[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]methyl]cyclobutane-1-carboxylic acid?
1-[[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]methyl]cyclobutane-1-carboxylic acid has a molecular weight of 287.32 g/mol, XLogP of 1.63, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[(5-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]methyl]cyclobutane-1-carboxylic acid is sourced from PubChem (CID 81369818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).