2-[1-[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]cyclobutyl]acetic acid

C13H16N4O2 — CID 103385131

IUPAC2-[1-[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]cyclobutyl]acetic acid
SMILESCn1cnc2c(NC3(CC(=O)O)CCC3)nccc21
InChIInChI=1S/C13H16N4O2/c1-17-8-15-11-9(17)3-6-14-12(11)16-13(4-2-5-13)7-10(18)19/h3,6,8H,2,4-5,7H2,1H3,(H,14,16)(H,18,19)
InChIKeyZTZLJODCTLOGBE-UHFFFAOYSA-N
MW260.30 g/mol
LogP1.78
Rot. Bonds4

About 2-[1-[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]cyclobutyl]acetic acid

2-[1-[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]cyclobutyl]acetic acid (PubChem CID 103385131) has the molecular formula C13H16N4O2 and a molecular weight of 260.30 g/mol. Its IUPAC name is 2-[1-[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]cyclobutyl]acetic acid.

Molecular Properties

Compound Name2-[1-[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]cyclobutyl]acetic acid
PubChem CID103385131
Molecular FormulaC13H16N4O2
Molecular Weight260.30 g/mol
Exact Mass260.13
IUPAC Name2-[1-[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]cyclobutyl]acetic acid
SMILESCn1cnc2c(NC3(CC(=O)O)CCC3)nccc21
InChIInChI=1S/C13H16N4O2/c1-17-8-15-11-9(17)3-6-14-12(11)16-13(4-2-5-13)7-10(18)19/h3,6,8H,2,4-5,7H2,1H3,(H,14,16)(H,18,19)
InChIKeyZTZLJODCTLOGBE-UHFFFAOYSA-N
XLogP1.78
TPSA80.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.30
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-(aminomethyl)cyclopentyl]-1-methylimidazo[4,5-c]pyridin-4-amine
CID 103386001
2-[1-(pyrazolo[1,5-a]pyrazin-4-ylamino)cyclopentyl]acetic acid
CID 104729585
2-[1-[(4-methyl-3-nitro-2-pyridinyl)amino]cyclobutyl]acetic acid
CID 79845326
1-[[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]methyl]cyclopentan-1-ol
CID 103385664
2-[1-[(3-nitro-2-pyridinyl)amino]cyclobutyl]acetic acid
CID 79846545
2-[1-[(3-methoxycarbonyl-2-pyridinyl)amino]cyclopentyl]acetic acid
CID 64700190
2-[1-[(3-cyano-2-pyridinyl)amino]cyclohexyl]acetic acid
CID 64700995
2-[1-[(5-bromoisoquinolin-1-yl)amino]cyclopentyl]acetic acid
CID 106536221
2-[1-(pyridin-4-ylamino)cyclopentyl]acetic acid
CID 64701158
2-[1-(1,3-thiazol-2-ylamino)cyclobutyl]acetic acid
CID 79846026
2-[1-[(3-carbamoylpyrazin-2-yl)amino]cyclohexyl]acetic acid
CID 64702363
4-methyl-6-[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]hexanoic acid
CID 103385090

Frequently Asked Questions

What is the IUPAC name of 2-[1-[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]cyclobutyl]acetic acid?
The IUPAC name of 2-[1-[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]cyclobutyl]acetic acid (CID 103385131) is 2-[1-[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]cyclobutyl]acetic acid.
What is the SMILES notation for 2-[1-[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]cyclobutyl]acetic acid?
The canonical SMILES for 2-[1-[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]cyclobutyl]acetic acid is Cn1cnc2c(NC3(CC(=O)O)CCC3)nccc21.
What is the InChIKey of 2-[1-[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]cyclobutyl]acetic acid?
The InChIKey is ZTZLJODCTLOGBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O2/c1-17-8-15-11-9(17)3-6-14-12(11)16-13(4-2-5-13)7-10(18)19/h3,6,8H,2,4-5,7H2,1H3,(H,14,16)(H,18,19).
What are the key properties of 2-[1-[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]cyclobutyl]acetic acid?
2-[1-[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]cyclobutyl]acetic acid has a molecular weight of 260.30 g/mol, XLogP of 1.78, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]cyclobutyl]acetic acid is sourced from PubChem (CID 103385131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).