4-ethyl-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)benzamide

C21H18N4O — CID 121033065

IUPAC4-ethyl-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)benzamide
SMILESCCc1ccc(C(=O)Nc2ccc(-c3cn4cccnc4n3)cc2)cc1
InChIInChI=1S/C21H18N4O/c1-2-15-4-6-17(7-5-15)20(26)23-18-10-8-16(9-11-18)19-14-25-13-3-12-22-21(25)24-19/h3-14H,2H2,1H3,(H,23,26)
InChIKeyPOJOKDCHQVOVGJ-UHFFFAOYSA-N
MW342.40 g/mol
LogP4.21
Rot. Bonds4

About 4-ethyl-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)benzamide

4-ethyl-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)benzamide (PubChem CID 121033065) has the molecular formula C21H18N4O and a molecular weight of 342.40 g/mol. Its IUPAC name is 4-ethyl-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)benzamide.

Molecular Properties

Compound Name4-ethyl-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)benzamide
PubChem CID121033065
Molecular FormulaC21H18N4O
Molecular Weight342.40 g/mol
Exact Mass342.15
IUPAC Name4-ethyl-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)benzamide
SMILESCCc1ccc(C(=O)Nc2ccc(-c3cn4cccnc4n3)cc2)cc1
InChIInChI=1S/C21H18N4O/c1-2-15-4-6-17(7-5-15)20(26)23-18-10-8-16(9-11-18)19-14-25-13-3-12-22-21(25)24-19/h3-14H,2H2,1H3,(H,23,26)
InChIKeyPOJOKDCHQVOVGJ-UHFFFAOYSA-N
XLogP4.21
TPSA59.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.40
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-chloro-6-ethoxy-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)pyridine-3-carboxamide
CID 99807438
N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-2,4-dimethylbenzamide
CID 121033061
N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-2-propylpentanamide
CID 20868684
4-butoxy-N-(3-imidazo[1,2-a]pyrimidin-2-ylphenyl)benzamide
CID 7080161
3-ethoxy-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-4-(2-oxo-2-piperidin-1-ylethoxy)benzamide
CID 55833726
N-(3-imidazo[1,2-a]pyrimidin-2-ylphenyl)-4-pentoxybenzamide
CID 122285167
3,4,5-triethoxy-N-(3-imidazo[1,2-a]pyrimidin-2-ylphenyl)benzamide
CID 27652156
4-butoxy-N-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)benzamide
CID 7080212
tert-butyl N-[4-[2-(4-imidazo[1,2-a]pyrimidin-2-ylanilino)-2-oxoethyl]phenyl]carbamate
CID 78893994
N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-3-[(2-oxopyrrolidin-1-yl)methyl]benzamide
CID 55825252
N-[2-chloro-5-[(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)carbamoyl]phenyl]thiophene-2-carboxamide
CID 55826534
N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-2-morpholin-4-ylacetamide
CID 75499509

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)benzamide?
The IUPAC name of 4-ethyl-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)benzamide (CID 121033065) is 4-ethyl-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)benzamide.
What is the SMILES notation for 4-ethyl-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)benzamide?
The canonical SMILES for 4-ethyl-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)benzamide is CCc1ccc(C(=O)Nc2ccc(-c3cn4cccnc4n3)cc2)cc1.
What is the InChIKey of 4-ethyl-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)benzamide?
The InChIKey is POJOKDCHQVOVGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N4O/c1-2-15-4-6-17(7-5-15)20(26)23-18-10-8-16(9-11-18)19-14-25-13-3-12-22-21(25)24-19/h3-14H,2H2,1H3,(H,23,26).
What are the key properties of 4-ethyl-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)benzamide?
4-ethyl-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)benzamide has a molecular weight of 342.40 g/mol, XLogP of 4.21, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)benzamide is sourced from PubChem (CID 121033065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).