N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-2-(1H-indol-3-yl)-2-oxoacetamide

C21H18N4O2 — CID 90569932

IUPACN-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-2-(1H-indol-3-yl)-2-oxoacetamide
SMILESO=C(C(=O)N(Cc1cnc2ccccn12)C1CC1)c1c[nH]c2ccccc12
InChIInChI=1S/C21H18N4O2/c26-20(17-12-22-18-6-2-1-5-16(17)18)21(27)25(14-8-9-14)13-15-11-23-19-7-3-4-10-24(15)19/h1-7,10-12,14,22H,8-9,13H2
InChIKeyMPMKVNGEKKGMLG-UHFFFAOYSA-N
MW358.40 g/mol
LogP3.19
Rot. Bonds5

About N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-2-(1H-indol-3-yl)-2-oxoacetamide

N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-2-(1H-indol-3-yl)-2-oxoacetamide (PubChem CID 90569932) has the molecular formula C21H18N4O2 and a molecular weight of 358.40 g/mol. Its IUPAC name is N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-2-(1H-indol-3-yl)-2-oxoacetamide.

Molecular Properties

Compound NameN-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-2-(1H-indol-3-yl)-2-oxoacetamide
PubChem CID90569932
Molecular FormulaC21H18N4O2
Molecular Weight358.40 g/mol
Exact Mass358.14
IUPAC NameN-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-2-(1H-indol-3-yl)-2-oxoacetamide
SMILESO=C(C(=O)N(Cc1cnc2ccccn12)C1CC1)c1c[nH]c2ccccc12
InChIInChI=1S/C21H18N4O2/c26-20(17-12-22-18-6-2-1-5-16(17)18)21(27)25(14-8-9-14)13-15-11-23-19-7-3-4-10-24(15)19/h1-7,10-12,14,22H,8-9,13H2
InChIKeyMPMKVNGEKKGMLG-UHFFFAOYSA-N
XLogP3.19
TPSA70.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.40
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

[4-(imidazo[1,2-a]pyridin-3-ylmethyl)piperazin-1-yl]-(1H-indol-3-yl)methanone
CID 90571872
1-cyclopropyl-1-(imidazo[1,2-a]pyridin-3-ylmethyl)-3-(naphthalen-1-ylmethyl)urea
CID 90570014
N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)quinoxaline-2-carboxamide
CID 90569964
N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)thiophene-3-carboxamide
CID 71801989
N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-4-methylthiadiazole-5-carboxamide
CID 90569958
3-bromo-N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzamide
CID 90569874
3-chloro-N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzamide
CID 90569872
N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-2-(3-methylphenoxy)acetamide
CID 90569909
1-cyclopropyl-1-(imidazo[1,2-a]pyridin-3-ylmethyl)-3-(3-methoxyphenyl)urea
CID 90569999
N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzenesulfonamide
CID 90570029
imidazo[1,2-a]pyridin-3-ylmethyl 4-(1H-indol-3-yl)butanoate
CID 71858389
N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)propane-2-sulfonamide
CID 90570063

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-2-(1H-indol-3-yl)-2-oxoacetamide?
The IUPAC name of N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-2-(1H-indol-3-yl)-2-oxoacetamide (CID 90569932) is N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-2-(1H-indol-3-yl)-2-oxoacetamide.
What is the SMILES notation for N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-2-(1H-indol-3-yl)-2-oxoacetamide?
The canonical SMILES for N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-2-(1H-indol-3-yl)-2-oxoacetamide is O=C(C(=O)N(Cc1cnc2ccccn12)C1CC1)c1c[nH]c2ccccc12.
What is the InChIKey of N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-2-(1H-indol-3-yl)-2-oxoacetamide?
The InChIKey is MPMKVNGEKKGMLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N4O2/c26-20(17-12-22-18-6-2-1-5-16(17)18)21(27)25(14-8-9-14)13-15-11-23-19-7-3-4-10-24(15)19/h1-7,10-12,14,22H,8-9,13H2.
What are the key properties of N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-2-(1H-indol-3-yl)-2-oxoacetamide?
N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-2-(1H-indol-3-yl)-2-oxoacetamide has a molecular weight of 358.40 g/mol, XLogP of 3.19, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-2-(1H-indol-3-yl)-2-oxoacetamide is sourced from PubChem (CID 90569932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).