2-(5-methyl-1H-imidazol-4-yl)-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine

C17H22N6O — CID 154620317

IUPAC2-(5-methyl-1H-imidazol-4-yl)-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine
SMILESCc1[nH]cnc1-c1nc2ccccn2c1NCCN1CCOCC1
InChIInChI=1S/C17H22N6O/c1-13-15(20-12-19-13)16-17(23-6-3-2-4-14(23)21-16)18-5-7-22-8-10-24-11-9-22/h2-4,6,12,18H,5,7-11H2,1H3,(H,19,20)
InChIKeyIQYCFBDHBTWZFI-UHFFFAOYSA-N
MW326.40 g/mol
LogP1.78
Rot. Bonds5

About 2-(5-methyl-1H-imidazol-4-yl)-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine

2-(5-methyl-1H-imidazol-4-yl)-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine (PubChem CID 154620317) has the molecular formula C17H22N6O and a molecular weight of 326.40 g/mol. Its IUPAC name is 2-(5-methyl-1H-imidazol-4-yl)-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound Name2-(5-methyl-1H-imidazol-4-yl)-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine
PubChem CID154620317
Molecular FormulaC17H22N6O
Molecular Weight326.40 g/mol
Exact Mass326.19
IUPAC Name2-(5-methyl-1H-imidazol-4-yl)-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine
SMILESCc1[nH]cnc1-c1nc2ccccn2c1NCCN1CCOCC1
InChIInChI=1S/C17H22N6O/c1-13-15(20-12-19-13)16-17(23-6-3-2-4-14(23)21-16)18-5-7-22-8-10-24-11-9-22/h2-4,6,12,18H,5,7-11H2,1H3,(H,19,20)
InChIKeyIQYCFBDHBTWZFI-UHFFFAOYSA-N
XLogP1.78
TPSA70.48 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(5-methyl-1H-imidazol-4-yl)-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine?
The IUPAC name of 2-(5-methyl-1H-imidazol-4-yl)-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine (CID 154620317) is 2-(5-methyl-1H-imidazol-4-yl)-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for 2-(5-methyl-1H-imidazol-4-yl)-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for 2-(5-methyl-1H-imidazol-4-yl)-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine is Cc1[nH]cnc1-c1nc2ccccn2c1NCCN1CCOCC1.
What is the InChIKey of 2-(5-methyl-1H-imidazol-4-yl)-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine?
The InChIKey is IQYCFBDHBTWZFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N6O/c1-13-15(20-12-19-13)16-17(23-6-3-2-4-14(23)21-16)18-5-7-22-8-10-24-11-9-22/h2-4,6,12,18H,5,7-11H2,1H3,(H,19,20).
What are the key properties of 2-(5-methyl-1H-imidazol-4-yl)-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine?
2-(5-methyl-1H-imidazol-4-yl)-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine has a molecular weight of 326.40 g/mol, XLogP of 1.78, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methyl-1H-imidazol-4-yl)-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 154620317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).