N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-3-(5-phenylfuran-2-yl)propanamide

C21H23N3O2 — CID 86772530

IUPACN-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-3-(5-phenylfuran-2-yl)propanamide
SMILESCc1cn2c(n1)CCC(NC(=O)CCc1ccc(-c3ccccc3)o1)C2
InChIInChI=1S/C21H23N3O2/c1-15-13-24-14-17(7-11-20(24)22-15)23-21(25)12-9-18-8-10-19(26-18)16-5-3-2-4-6-16/h2-6,8,10,13,17H,7,9,11-12,14H2,1H3,(H,23,25)
InChIKeyMTXYUCUSMPKRHA-UHFFFAOYSA-N
MW349.43 g/mol
LogP3.52
Rot. Bonds5

About N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-3-(5-phenylfuran-2-yl)propanamide

N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-3-(5-phenylfuran-2-yl)propanamide (PubChem CID 86772530) has the molecular formula C21H23N3O2 and a molecular weight of 349.43 g/mol. Its IUPAC name is N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-3-(5-phenylfuran-2-yl)propanamide.

Molecular Properties

Compound NameN-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-3-(5-phenylfuran-2-yl)propanamide
PubChem CID86772530
Molecular FormulaC21H23N3O2
Molecular Weight349.43 g/mol
Exact Mass349.18
IUPAC NameN-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-3-(5-phenylfuran-2-yl)propanamide
SMILESCc1cn2c(n1)CCC(NC(=O)CCc1ccc(-c3ccccc3)o1)C2
InChIInChI=1S/C21H23N3O2/c1-15-13-24-14-17(7-11-20(24)22-15)23-21(25)12-9-18-8-10-19(26-18)16-5-3-2-4-6-16/h2-6,8,10,13,17H,7,9,11-12,14H2,1H3,(H,23,25)
InChIKeyMTXYUCUSMPKRHA-UHFFFAOYSA-N
XLogP3.52
TPSA60.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.43
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-3-(5-phenylfuran-2-yl)propanamide?
The IUPAC name of N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-3-(5-phenylfuran-2-yl)propanamide (CID 86772530) is N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-3-(5-phenylfuran-2-yl)propanamide.
What is the SMILES notation for N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-3-(5-phenylfuran-2-yl)propanamide?
The canonical SMILES for N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-3-(5-phenylfuran-2-yl)propanamide is Cc1cn2c(n1)CCC(NC(=O)CCc1ccc(-c3ccccc3)o1)C2.
What is the InChIKey of N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-3-(5-phenylfuran-2-yl)propanamide?
The InChIKey is MTXYUCUSMPKRHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N3O2/c1-15-13-24-14-17(7-11-20(24)22-15)23-21(25)12-9-18-8-10-19(26-18)16-5-3-2-4-6-16/h2-6,8,10,13,17H,7,9,11-12,14H2,1H3,(H,23,25).
What are the key properties of N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-3-(5-phenylfuran-2-yl)propanamide?
N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-3-(5-phenylfuran-2-yl)propanamide has a molecular weight of 349.43 g/mol, XLogP of 3.52, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-3-(5-phenylfuran-2-yl)propanamide is sourced from PubChem (CID 86772530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).