3-[2-methyl-4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenoxy]-N,N-dipropylpropan-1-amine

C24H33N3O — CID 10110274

IUPAC3-[2-methyl-4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenoxy]-N,N-dipropylpropan-1-amine
SMILESCCCN(CCC)CCCOc1ccc(-c2cn3cccc(C)c3n2)cc1C
InChIInChI=1S/C24H33N3O/c1-5-12-26(13-6-2)14-8-16-28-23-11-10-21(17-20(23)4)22-18-27-15-7-9-19(3)24(27)25-22/h7,9-11,15,17-18H,5-6,8,12-14,16H2,1-4H3
InChIKeyKCHXEGFYEDQOTA-UHFFFAOYSA-N
MW379.55 g/mol
LogP5.51
Rot. Bonds10

About 3-[2-methyl-4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenoxy]-N,N-dipropylpropan-1-amine

3-[2-methyl-4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenoxy]-N,N-dipropylpropan-1-amine (PubChem CID 10110274) has the molecular formula C24H33N3O and a molecular weight of 379.55 g/mol. Its IUPAC name is 3-[2-methyl-4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenoxy]-N,N-dipropylpropan-1-amine.

Molecular Properties

Compound Name3-[2-methyl-4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenoxy]-N,N-dipropylpropan-1-amine
PubChem CID10110274
Molecular FormulaC24H33N3O
Molecular Weight379.55 g/mol
Exact Mass379.26
IUPAC Name3-[2-methyl-4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenoxy]-N,N-dipropylpropan-1-amine
SMILESCCCN(CCC)CCCOc1ccc(-c2cn3cccc(C)c3n2)cc1C
InChIInChI=1S/C24H33N3O/c1-5-12-26(13-6-2)14-8-16-28-23-11-10-21(17-20(23)4)22-18-27-15-7-9-19(3)24(27)25-22/h7,9-11,15,17-18H,5-6,8,12-14,16H2,1-4H3
InChIKeyKCHXEGFYEDQOTA-UHFFFAOYSA-N
XLogP5.51
TPSA29.77 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500379.55
LogP ≤ 55.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-[2-methyl-4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenoxy]-N,N-dipropylpropan-1-amine?
The IUPAC name of 3-[2-methyl-4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenoxy]-N,N-dipropylpropan-1-amine (CID 10110274) is 3-[2-methyl-4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenoxy]-N,N-dipropylpropan-1-amine.
What is the SMILES notation for 3-[2-methyl-4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenoxy]-N,N-dipropylpropan-1-amine?
The canonical SMILES for 3-[2-methyl-4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenoxy]-N,N-dipropylpropan-1-amine is CCCN(CCC)CCCOc1ccc(-c2cn3cccc(C)c3n2)cc1C.
What is the InChIKey of 3-[2-methyl-4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenoxy]-N,N-dipropylpropan-1-amine?
The InChIKey is KCHXEGFYEDQOTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H33N3O/c1-5-12-26(13-6-2)14-8-16-28-23-11-10-21(17-20(23)4)22-18-27-15-7-9-19(3)24(27)25-22/h7,9-11,15,17-18H,5-6,8,12-14,16H2,1-4H3.
What are the key properties of 3-[2-methyl-4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenoxy]-N,N-dipropylpropan-1-amine?
3-[2-methyl-4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenoxy]-N,N-dipropylpropan-1-amine has a molecular weight of 379.55 g/mol, XLogP of 5.51, 10 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-methyl-4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenoxy]-N,N-dipropylpropan-1-amine is sourced from PubChem (CID 10110274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).