2-imidazol-1-yl-N-[4-(2-methoxyethoxy)cyclohexyl]pyridine-4-carboxamide

C18H24N4O3 — CID 156885753

IUPAC2-imidazol-1-yl-N-[4-(2-methoxyethoxy)cyclohexyl]pyridine-4-carboxamide
SMILESCOCCOC1CCC(NC(=O)c2ccnc(-n3ccnc3)c2)CC1
InChIInChI=1S/C18H24N4O3/c1-24-10-11-25-16-4-2-15(3-5-16)21-18(23)14-6-7-20-17(12-14)22-9-8-19-13-22/h6-9,12-13,15-16H,2-5,10-11H2,1H3,(H,21,23)
InChIKeyROHVSWYPCYJUQD-UHFFFAOYSA-N
MW344.42 g/mol
LogP1.97
Rot. Bonds7

About 2-imidazol-1-yl-N-[4-(2-methoxyethoxy)cyclohexyl]pyridine-4-carboxamide

2-imidazol-1-yl-N-[4-(2-methoxyethoxy)cyclohexyl]pyridine-4-carboxamide (PubChem CID 156885753) has the molecular formula C18H24N4O3 and a molecular weight of 344.42 g/mol. Its IUPAC name is 2-imidazol-1-yl-N-[4-(2-methoxyethoxy)cyclohexyl]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-imidazol-1-yl-N-[4-(2-methoxyethoxy)cyclohexyl]pyridine-4-carboxamide
PubChem CID156885753
Molecular FormulaC18H24N4O3
Molecular Weight344.42 g/mol
Exact Mass344.18
IUPAC Name2-imidazol-1-yl-N-[4-(2-methoxyethoxy)cyclohexyl]pyridine-4-carboxamide
SMILESCOCCOC1CCC(NC(=O)c2ccnc(-n3ccnc3)c2)CC1
InChIInChI=1S/C18H24N4O3/c1-24-10-11-25-16-4-2-15(3-5-16)21-18(23)14-6-7-20-17(12-14)22-9-8-19-13-22/h6-9,12-13,15-16H,2-5,10-11H2,1H3,(H,21,23)
InChIKeyROHVSWYPCYJUQD-UHFFFAOYSA-N
XLogP1.97
TPSA78.27 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.42
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2,6-di(imidazol-1-yl)-N-[4-(2-methoxyethoxy)cyclohexyl]pyridine-4-carboxamide
CID 156885976
5-imidazol-1-yl-N-[4-(2-methoxyethoxy)cyclohexyl]thieno[3,2-b]pyridine-7-carboxamide
CID 155598604
N-(1-tert-butylpyrrolidin-3-yl)-2-imidazol-1-ylpyridine-4-carboxamide
CID 166481590
2-imidazol-1-yl-N-(2-methylpiperidin-4-yl)pyridine-4-carboxamide;dihydrochloride
CID 120598171
2-imidazol-1-yl-N-[2-[(1R,2S)-2-methylcyclohexyl]oxyethyl]pyridine-4-carboxamide
CID 94180241
2-imidazol-1-yl-N-[(3R)-1-methylsulfonylpiperidin-3-yl]pyridine-4-carboxamide
CID 94818852
2-imidazol-1-yl-N-[4-(2-methoxyethoxy)cyclohexyl]-7-methyl-5H-pyrrolo[3,2-d]pyrimidine-4-carboxamide
CID 155598624
N-[4-(diethylamino)-4-oxobutyl]-2-imidazol-1-ylpyridine-4-carboxamide
CID 51090160
N-(2-amino-1-cyclohexylethyl)-2-imidazol-1-ylpyridine-4-carboxamide
CID 119591870
N-[cyclopropyl-(4-methoxyphenyl)methyl]-2-imidazol-1-ylpyridine-4-carboxamide
CID 51085911
N-(4-ethylphenyl)-2-imidazol-1-ylpyridine-4-carboxamide
CID 87010836
N-cyclohexyl-6-imidazol-1-ylpyridine-2-carboxamide;2-methoxyethanol;molecular hydrogen
CID 156885840

Frequently Asked Questions

What is the IUPAC name of 2-imidazol-1-yl-N-[4-(2-methoxyethoxy)cyclohexyl]pyridine-4-carboxamide?
The IUPAC name of 2-imidazol-1-yl-N-[4-(2-methoxyethoxy)cyclohexyl]pyridine-4-carboxamide (CID 156885753) is 2-imidazol-1-yl-N-[4-(2-methoxyethoxy)cyclohexyl]pyridine-4-carboxamide.
What is the SMILES notation for 2-imidazol-1-yl-N-[4-(2-methoxyethoxy)cyclohexyl]pyridine-4-carboxamide?
The canonical SMILES for 2-imidazol-1-yl-N-[4-(2-methoxyethoxy)cyclohexyl]pyridine-4-carboxamide is COCCOC1CCC(NC(=O)c2ccnc(-n3ccnc3)c2)CC1.
What is the InChIKey of 2-imidazol-1-yl-N-[4-(2-methoxyethoxy)cyclohexyl]pyridine-4-carboxamide?
The InChIKey is ROHVSWYPCYJUQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O3/c1-24-10-11-25-16-4-2-15(3-5-16)21-18(23)14-6-7-20-17(12-14)22-9-8-19-13-22/h6-9,12-13,15-16H,2-5,10-11H2,1H3,(H,21,23).
What are the key properties of 2-imidazol-1-yl-N-[4-(2-methoxyethoxy)cyclohexyl]pyridine-4-carboxamide?
2-imidazol-1-yl-N-[4-(2-methoxyethoxy)cyclohexyl]pyridine-4-carboxamide has a molecular weight of 344.42 g/mol, XLogP of 1.97, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-imidazol-1-yl-N-[4-(2-methoxyethoxy)cyclohexyl]pyridine-4-carboxamide is sourced from PubChem (CID 156885753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).