N-[1-(3-hydroxycyclobutyl)-2-phenylethyl]imidazo[1,2-a]pyridine-6-carboxamide

C20H21N3O2 — CID 91767171

IUPACN-[1-(3-hydroxycyclobutyl)-2-phenylethyl]imidazo[1,2-a]pyridine-6-carboxamide
SMILESO=C(NC(Cc1ccccc1)C1CC(O)C1)c1ccc2nccn2c1
InChIInChI=1S/C20H21N3O2/c24-17-11-16(12-17)18(10-14-4-2-1-3-5-14)22-20(25)15-6-7-19-21-8-9-23(19)13-15/h1-9,13,16-18,24H,10-12H2,(H,22,25)
InChIKeyCKBGZSDDILFNKT-UHFFFAOYSA-N
MW335.41 g/mol
LogP2.45
Rot. Bonds5

About N-[1-(3-hydroxycyclobutyl)-2-phenylethyl]imidazo[1,2-a]pyridine-6-carboxamide

N-[1-(3-hydroxycyclobutyl)-2-phenylethyl]imidazo[1,2-a]pyridine-6-carboxamide (PubChem CID 91767171) has the molecular formula C20H21N3O2 and a molecular weight of 335.41 g/mol. Its IUPAC name is N-[1-(3-hydroxycyclobutyl)-2-phenylethyl]imidazo[1,2-a]pyridine-6-carboxamide.

Molecular Properties

Compound NameN-[1-(3-hydroxycyclobutyl)-2-phenylethyl]imidazo[1,2-a]pyridine-6-carboxamide
PubChem CID91767171
Molecular FormulaC20H21N3O2
Molecular Weight335.41 g/mol
Exact Mass335.16
IUPAC NameN-[1-(3-hydroxycyclobutyl)-2-phenylethyl]imidazo[1,2-a]pyridine-6-carboxamide
SMILESO=C(NC(Cc1ccccc1)C1CC(O)C1)c1ccc2nccn2c1
InChIInChI=1S/C20H21N3O2/c24-17-11-16(12-17)18(10-14-4-2-1-3-5-14)22-20(25)15-6-7-19-21-8-9-23(19)13-15/h1-9,13,16-18,24H,10-12H2,(H,22,25)
InChIKeyCKBGZSDDILFNKT-UHFFFAOYSA-N
XLogP2.45
TPSA66.63 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.41
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(3-hydroxycyclobutyl)-2-phenylethyl]-6-oxo-1H-pyridine-3-carboxamide
CID 91788825
N-(2-amino-1-cyclohexylethyl)imidazo[1,2-a]pyridine-6-carboxamide;dihydrochloride
CID 119590118
N-(3-phenylpropyl)imidazo[1,2-a]pyridine-6-carboxamide
CID 110704012
(2R)-2-(imidazo[1,2-a]pyridine-6-carbonylamino)-4-methylpentanoic acid
CID 119363473
N-[(1R)-1-piperidin-4-ylethyl]imidazo[1,2-a]pyridine-6-carboxamide
CID 166248842
N-[1-(3-hydroxycyclobutyl)-2-pyridin-4-ylethyl]-3-pyrazol-1-ylbenzamide
CID 91776192
6-cyano-N-[1-(3-hydroxycyclobutyl)-2-pyridin-4-ylethyl]pyridine-3-carboxamide
CID 91767901
N-(4-phenyldiazenylphenyl)imidazo[1,2-a]pyridine-6-carboxamide
CID 52880425
N-[(1R,4R,5R)-2-azabicyclo[2.2.1]heptan-5-yl]imidazo[1,2-a]pyridine-6-carboxamide
CID 93499229
methyl 3-(imidazo[1,2-a]pyridine-6-carbonylamino)-2-methyl-3-phenylpropanoate
CID 86778568
methyl (2R,3R)-3-(imidazo[1,2-a]pyridine-6-carbonylamino)-2-methyl-3-phenylpropanoate
CID 96559511
N-[1-(3-hydroxycyclobutyl)-2-pyridin-2-ylethyl]-2,3-dihydro-1H-indene-5-carboxamide
CID 91788033

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-hydroxycyclobutyl)-2-phenylethyl]imidazo[1,2-a]pyridine-6-carboxamide?
The IUPAC name of N-[1-(3-hydroxycyclobutyl)-2-phenylethyl]imidazo[1,2-a]pyridine-6-carboxamide (CID 91767171) is N-[1-(3-hydroxycyclobutyl)-2-phenylethyl]imidazo[1,2-a]pyridine-6-carboxamide.
What is the SMILES notation for N-[1-(3-hydroxycyclobutyl)-2-phenylethyl]imidazo[1,2-a]pyridine-6-carboxamide?
The canonical SMILES for N-[1-(3-hydroxycyclobutyl)-2-phenylethyl]imidazo[1,2-a]pyridine-6-carboxamide is O=C(NC(Cc1ccccc1)C1CC(O)C1)c1ccc2nccn2c1.
What is the InChIKey of N-[1-(3-hydroxycyclobutyl)-2-phenylethyl]imidazo[1,2-a]pyridine-6-carboxamide?
The InChIKey is CKBGZSDDILFNKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O2/c24-17-11-16(12-17)18(10-14-4-2-1-3-5-14)22-20(25)15-6-7-19-21-8-9-23(19)13-15/h1-9,13,16-18,24H,10-12H2,(H,22,25).
What are the key properties of N-[1-(3-hydroxycyclobutyl)-2-phenylethyl]imidazo[1,2-a]pyridine-6-carboxamide?
N-[1-(3-hydroxycyclobutyl)-2-phenylethyl]imidazo[1,2-a]pyridine-6-carboxamide has a molecular weight of 335.41 g/mol, XLogP of 2.45, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-hydroxycyclobutyl)-2-phenylethyl]imidazo[1,2-a]pyridine-6-carboxamide is sourced from PubChem (CID 91767171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).