8-(cyclohexylmethoxy)-2-ethenyl-N-[(2R)-3-ethyl-1-hydroxypent-4-en-2-yl]imidazo[1,2-a]pyridine-3-carboxamide

C24H33N3O3 — CID 147964608

IUPAC8-(cyclohexylmethoxy)-2-ethenyl-N-[(2R)-3-ethyl-1-hydroxypent-4-en-2-yl]imidazo[1,2-a]pyridine-3-carboxamide
SMILESC=Cc1nc2c(OCC3CCCCC3)cccn2c1C(=O)N[C@@H](CO)C(C=C)CC
InChIInChI=1S/C24H33N3O3/c1-4-18(5-2)20(15-28)26-24(29)22-19(6-3)25-23-21(13-10-14-27(22)23)30-16-17-11-8-7-9-12-17/h4,6,10,13-14,17-18,20,28H,1,3,5,7-9,11-12,15-16H2,2H3,(H,26,29)/t18?,20-/m0/s1
InChIKeyIQDKYASSRXQJLC-IJHRGXPZSA-N
MW411.55 g/mol
LogP4.24
Rot. Bonds10

About 8-(cyclohexylmethoxy)-2-ethenyl-N-[(2R)-3-ethyl-1-hydroxypent-4-en-2-yl]imidazo[1,2-a]pyridine-3-carboxamide

8-(cyclohexylmethoxy)-2-ethenyl-N-[(2R)-3-ethyl-1-hydroxypent-4-en-2-yl]imidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 147964608) has the molecular formula C24H33N3O3 and a molecular weight of 411.55 g/mol. Its IUPAC name is 8-(cyclohexylmethoxy)-2-ethenyl-N-[(2R)-3-ethyl-1-hydroxypent-4-en-2-yl]imidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name8-(cyclohexylmethoxy)-2-ethenyl-N-[(2R)-3-ethyl-1-hydroxypent-4-en-2-yl]imidazo[1,2-a]pyridine-3-carboxamide
PubChem CID147964608
Molecular FormulaC24H33N3O3
Molecular Weight411.55 g/mol
Exact Mass411.25
IUPAC Name8-(cyclohexylmethoxy)-2-ethenyl-N-[(2R)-3-ethyl-1-hydroxypent-4-en-2-yl]imidazo[1,2-a]pyridine-3-carboxamide
SMILESC=Cc1nc2c(OCC3CCCCC3)cccn2c1C(=O)N[C@@H](CO)C(C=C)CC
InChIInChI=1S/C24H33N3O3/c1-4-18(5-2)20(15-28)26-24(29)22-19(6-3)25-23-21(13-10-14-27(22)23)30-16-17-11-8-7-9-12-17/h4,6,10,13-14,17-18,20,28H,1,3,5,7-9,11-12,15-16H2,2H3,(H,26,29)/t18?,20-/m0/s1
InChIKeyIQDKYASSRXQJLC-IJHRGXPZSA-N
XLogP4.24
TPSA75.86 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500411.55
LogP ≤ 54.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

8-(cyclohexylmethoxy)-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide
CID 90115913
8-(cyclohexylmethoxy)-2-ethyl-N-[(2R)-1-hydroxypropan-2-yl]imidazo[1,2-a]pyridine-3-carboxamide;formic acid
CID 90115741
methyl 2-[[8-(cyclohexylmethoxy)-2-methylimidazo[1,2-a]pyridine-3-carbonyl]amino]-3-hydroxypropanoate
CID 90072576
8-(cyclohexylmethoxy)-N-(1-hydroxyhexan-2-yl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide
CID 90115553
8-(cyclohexylmethoxy)-2-propylimidazo[1,2-a]pyridine-3-carboxylic acid
CID 90132429
N-cyclohexyl-8-(cyclohexylmethoxy)-2-methylimidazo[1,2-a]pyridine-3-carboxamide
CID 129267906
8-(cyclohexylmethoxy)-2-methylimidazo[1,2-a]pyridine-3-carboxylic acid;dihydrochloride
CID 90072983
8-(cyclohexylmethoxy)-N-[(3S,5S)-5-(hydroxymethyl)-1-methylpyrrolidin-3-yl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide;dihydrochloride
CID 86713514
methyl (2R)-2-[[8-(cyclohexylmethoxy)-2-methylimidazo[1,2-a]pyridine-3-carbonyl]amino]-3-(2-methylphenyl)propanoate
CID 140636860
8-(cyclohexylmethoxy)-2-methyl-N-[(3S)-pyrrolidin-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;dihydrochloride
CID 86713482
8-(cyclohexylmethoxy)-2-methyl-N-[(3S)-piperidin-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;dihydrochloride
CID 86713490
N-[(1R)-2-hydroxy-1-phenylethyl]-2-methyl-8-(spiro[3.5]nonan-7-ylmethoxy)imidazo[1,2-a]pyridine-3-carboxamide
CID 90090874

Frequently Asked Questions

What is the IUPAC name of 8-(cyclohexylmethoxy)-2-ethenyl-N-[(2R)-3-ethyl-1-hydroxypent-4-en-2-yl]imidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of 8-(cyclohexylmethoxy)-2-ethenyl-N-[(2R)-3-ethyl-1-hydroxypent-4-en-2-yl]imidazo[1,2-a]pyridine-3-carboxamide (CID 147964608) is 8-(cyclohexylmethoxy)-2-ethenyl-N-[(2R)-3-ethyl-1-hydroxypent-4-en-2-yl]imidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for 8-(cyclohexylmethoxy)-2-ethenyl-N-[(2R)-3-ethyl-1-hydroxypent-4-en-2-yl]imidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for 8-(cyclohexylmethoxy)-2-ethenyl-N-[(2R)-3-ethyl-1-hydroxypent-4-en-2-yl]imidazo[1,2-a]pyridine-3-carboxamide is C=Cc1nc2c(OCC3CCCCC3)cccn2c1C(=O)N[C@@H](CO)C(C=C)CC.
What is the InChIKey of 8-(cyclohexylmethoxy)-2-ethenyl-N-[(2R)-3-ethyl-1-hydroxypent-4-en-2-yl]imidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is IQDKYASSRXQJLC-IJHRGXPZSA-N. The full InChI is InChI=1S/C24H33N3O3/c1-4-18(5-2)20(15-28)26-24(29)22-19(6-3)25-23-21(13-10-14-27(22)23)30-16-17-11-8-7-9-12-17/h4,6,10,13-14,17-18,20,28H,1,3,5,7-9,11-12,15-16H2,2H3,(H,26,29)/t18?,20-/m0/s1.
What are the key properties of 8-(cyclohexylmethoxy)-2-ethenyl-N-[(2R)-3-ethyl-1-hydroxypent-4-en-2-yl]imidazo[1,2-a]pyridine-3-carboxamide?
8-(cyclohexylmethoxy)-2-ethenyl-N-[(2R)-3-ethyl-1-hydroxypent-4-en-2-yl]imidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 411.55 g/mol, XLogP of 4.24, 10 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(cyclohexylmethoxy)-2-ethenyl-N-[(2R)-3-ethyl-1-hydroxypent-4-en-2-yl]imidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 147964608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).