N-[(1-hydroxy-4-methylcyclohexyl)methyl]imidazo[1,2-a]pyridine-2-carboxamide

C16H21N3O2 — CID 65119667

IUPACN-[(1-hydroxy-4-methylcyclohexyl)methyl]imidazo[1,2-a]pyridine-2-carboxamide
SMILESCC1CCC(O)(CNC(=O)c2cn3ccccc3n2)CC1
InChIInChI=1S/C16H21N3O2/c1-12-5-7-16(21,8-6-12)11-17-15(20)13-10-19-9-3-2-4-14(19)18-13/h2-4,9-10,12,21H,5-8,11H2,1H3,(H,17,20)
InChIKeyNNXARQMADOPXIT-UHFFFAOYSA-N
MW287.36 g/mol
LogP2.01
Rot. Bonds3

About N-[(1-hydroxy-4-methylcyclohexyl)methyl]imidazo[1,2-a]pyridine-2-carboxamide

N-[(1-hydroxy-4-methylcyclohexyl)methyl]imidazo[1,2-a]pyridine-2-carboxamide (PubChem CID 65119667) has the molecular formula C16H21N3O2 and a molecular weight of 287.36 g/mol. Its IUPAC name is N-[(1-hydroxy-4-methylcyclohexyl)methyl]imidazo[1,2-a]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[(1-hydroxy-4-methylcyclohexyl)methyl]imidazo[1,2-a]pyridine-2-carboxamide
PubChem CID65119667
Molecular FormulaC16H21N3O2
Molecular Weight287.36 g/mol
Exact Mass287.16
IUPAC NameN-[(1-hydroxy-4-methylcyclohexyl)methyl]imidazo[1,2-a]pyridine-2-carboxamide
SMILESCC1CCC(O)(CNC(=O)c2cn3ccccc3n2)CC1
InChIInChI=1S/C16H21N3O2/c1-12-5-7-16(21,8-6-12)11-17-15(20)13-10-19-9-3-2-4-14(19)18-13/h2-4,9-10,12,21H,5-8,11H2,1H3,(H,17,20)
InChIKeyNNXARQMADOPXIT-UHFFFAOYSA-N
XLogP2.01
TPSA66.63 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-[(imidazo[1,2-a]pyridine-2-carbonylamino)methyl]cyclobutane-1-carboxylic acid
CID 81362941
N-[(4-carbamoyloxan-4-yl)methyl]imidazo[1,2-a]pyridine-2-carboxamide
CID 56817800
N-[(1-hydroxy-4-methylcyclohexyl)methyl]-6-methylpyridine-2-carboxamide
CID 65118974
N-[2-[(1R,2R)-2-hydroxycyclohexyl]ethyl]imidazo[1,2-a]pyridine-2-carboxamide
CID 136587148
N-[4-(imidazo[1,2-a]pyridine-2-carbonylamino)cyclohexyl]imidazo[1,2-a]pyridine-2-carboxamide
CID 171722185
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-[(2,4,6-trimethylphenyl)methyl]imidazo[1,2-a]pyridine-2-carboxamide
CID 87051271
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
N-[(1-hydroxy-4-methylcyclohexyl)methyl]-1-propylpyrrole-2-carboxamide
CID 65119021
N-[(1-hydroxycyclobutyl)methyl]-5-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 115643362

Frequently Asked Questions

What is the IUPAC name of N-[(1-hydroxy-4-methylcyclohexyl)methyl]imidazo[1,2-a]pyridine-2-carboxamide?
The IUPAC name of N-[(1-hydroxy-4-methylcyclohexyl)methyl]imidazo[1,2-a]pyridine-2-carboxamide (CID 65119667) is N-[(1-hydroxy-4-methylcyclohexyl)methyl]imidazo[1,2-a]pyridine-2-carboxamide.
What is the SMILES notation for N-[(1-hydroxy-4-methylcyclohexyl)methyl]imidazo[1,2-a]pyridine-2-carboxamide?
The canonical SMILES for N-[(1-hydroxy-4-methylcyclohexyl)methyl]imidazo[1,2-a]pyridine-2-carboxamide is CC1CCC(O)(CNC(=O)c2cn3ccccc3n2)CC1.
What is the InChIKey of N-[(1-hydroxy-4-methylcyclohexyl)methyl]imidazo[1,2-a]pyridine-2-carboxamide?
The InChIKey is NNXARQMADOPXIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O2/c1-12-5-7-16(21,8-6-12)11-17-15(20)13-10-19-9-3-2-4-14(19)18-13/h2-4,9-10,12,21H,5-8,11H2,1H3,(H,17,20).
What are the key properties of N-[(1-hydroxy-4-methylcyclohexyl)methyl]imidazo[1,2-a]pyridine-2-carboxamide?
N-[(1-hydroxy-4-methylcyclohexyl)methyl]imidazo[1,2-a]pyridine-2-carboxamide has a molecular weight of 287.36 g/mol, XLogP of 2.01, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-hydroxy-4-methylcyclohexyl)methyl]imidazo[1,2-a]pyridine-2-carboxamide is sourced from PubChem (CID 65119667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).