N-(imidazo[1,5-a]pyridin-5-ylmethyl)-1-(2-morpholin-4-ylphenyl)ethanamine

C20H24N4O — CID 166305501

IUPACN-(imidazo[1,5-a]pyridin-5-ylmethyl)-1-(2-morpholin-4-ylphenyl)ethanamine
SMILESCC(NCc1cccc2cncn12)c1ccccc1N1CCOCC1
InChIInChI=1S/C20H24N4O/c1-16(22-14-18-6-4-5-17-13-21-15-24(17)18)19-7-2-3-8-20(19)23-9-11-25-12-10-23/h2-8,13,15-16,22H,9-12,14H2,1H3
InChIKeyBZBYKIGTZVBVFF-UHFFFAOYSA-N
MW336.44 g/mol
LogP3.02
Rot. Bonds5

About N-(imidazo[1,5-a]pyridin-5-ylmethyl)-1-(2-morpholin-4-ylphenyl)ethanamine

N-(imidazo[1,5-a]pyridin-5-ylmethyl)-1-(2-morpholin-4-ylphenyl)ethanamine (PubChem CID 166305501) has the molecular formula C20H24N4O and a molecular weight of 336.44 g/mol. Its IUPAC name is N-(imidazo[1,5-a]pyridin-5-ylmethyl)-1-(2-morpholin-4-ylphenyl)ethanamine.

Molecular Properties

Compound NameN-(imidazo[1,5-a]pyridin-5-ylmethyl)-1-(2-morpholin-4-ylphenyl)ethanamine
PubChem CID166305501
Molecular FormulaC20H24N4O
Molecular Weight336.44 g/mol
Exact Mass336.20
IUPAC NameN-(imidazo[1,5-a]pyridin-5-ylmethyl)-1-(2-morpholin-4-ylphenyl)ethanamine
SMILESCC(NCc1cccc2cncn12)c1ccccc1N1CCOCC1
InChIInChI=1S/C20H24N4O/c1-16(22-14-18-6-4-5-17-13-21-15-24(17)18)19-7-2-3-8-20(19)23-9-11-25-12-10-23/h2-8,13,15-16,22H,9-12,14H2,1H3
InChIKeyBZBYKIGTZVBVFF-UHFFFAOYSA-N
XLogP3.02
TPSA41.80 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.44
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(imidazo[1,5-a]pyridin-5-ylmethyl)-1-(2-morpholin-4-ylphenyl)ethanamine?
The IUPAC name of N-(imidazo[1,5-a]pyridin-5-ylmethyl)-1-(2-morpholin-4-ylphenyl)ethanamine (CID 166305501) is N-(imidazo[1,5-a]pyridin-5-ylmethyl)-1-(2-morpholin-4-ylphenyl)ethanamine.
What is the SMILES notation for N-(imidazo[1,5-a]pyridin-5-ylmethyl)-1-(2-morpholin-4-ylphenyl)ethanamine?
The canonical SMILES for N-(imidazo[1,5-a]pyridin-5-ylmethyl)-1-(2-morpholin-4-ylphenyl)ethanamine is CC(NCc1cccc2cncn12)c1ccccc1N1CCOCC1.
What is the InChIKey of N-(imidazo[1,5-a]pyridin-5-ylmethyl)-1-(2-morpholin-4-ylphenyl)ethanamine?
The InChIKey is BZBYKIGTZVBVFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N4O/c1-16(22-14-18-6-4-5-17-13-21-15-24(17)18)19-7-2-3-8-20(19)23-9-11-25-12-10-23/h2-8,13,15-16,22H,9-12,14H2,1H3.
What are the key properties of N-(imidazo[1,5-a]pyridin-5-ylmethyl)-1-(2-morpholin-4-ylphenyl)ethanamine?
N-(imidazo[1,5-a]pyridin-5-ylmethyl)-1-(2-morpholin-4-ylphenyl)ethanamine has a molecular weight of 336.44 g/mol, XLogP of 3.02, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(imidazo[1,5-a]pyridin-5-ylmethyl)-1-(2-morpholin-4-ylphenyl)ethanamine is sourced from PubChem (CID 166305501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).