2-(furan-3-yl)-7-methyl-N-(2-methylheptan-2-yl)imidazo[1,2-a]pyridin-3-amine

C20H27N3O — CID 11573398

IUPAC2-(furan-3-yl)-7-methyl-N-(2-methylheptan-2-yl)imidazo[1,2-a]pyridin-3-amine
SMILESCCCCCC(C)(C)Nc1c(-c2ccoc2)nc2cc(C)ccn12
InChIInChI=1S/C20H27N3O/c1-5-6-7-10-20(3,4)22-19-18(16-9-12-24-14-16)21-17-13-15(2)8-11-23(17)19/h8-9,11-14,22H,5-7,10H2,1-4H3
InChIKeyORCIECZQEHJZGB-UHFFFAOYSA-N
MW325.46 g/mol
LogP5.67
Rot. Bonds7

About 2-(furan-3-yl)-7-methyl-N-(2-methylheptan-2-yl)imidazo[1,2-a]pyridin-3-amine

2-(furan-3-yl)-7-methyl-N-(2-methylheptan-2-yl)imidazo[1,2-a]pyridin-3-amine (PubChem CID 11573398) has the molecular formula C20H27N3O and a molecular weight of 325.46 g/mol. Its IUPAC name is 2-(furan-3-yl)-7-methyl-N-(2-methylheptan-2-yl)imidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound Name2-(furan-3-yl)-7-methyl-N-(2-methylheptan-2-yl)imidazo[1,2-a]pyridin-3-amine
PubChem CID11573398
Molecular FormulaC20H27N3O
Molecular Weight325.46 g/mol
Exact Mass325.22
IUPAC Name2-(furan-3-yl)-7-methyl-N-(2-methylheptan-2-yl)imidazo[1,2-a]pyridin-3-amine
SMILESCCCCCC(C)(C)Nc1c(-c2ccoc2)nc2cc(C)ccn12
InChIInChI=1S/C20H27N3O/c1-5-6-7-10-20(3,4)22-19-18(16-9-12-24-14-16)21-17-13-15(2)8-11-23(17)19/h8-9,11-14,22H,5-7,10H2,1-4H3
InChIKeyORCIECZQEHJZGB-UHFFFAOYSA-N
XLogP5.67
TPSA42.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500325.46
LogP ≤ 55.67
H-Bond Donors ≤ 51
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 2-(furan-3-yl)-7-methyl-N-(2-methylheptan-2-yl)imidazo[1,2-a]pyridin-3-amine?
The IUPAC name of 2-(furan-3-yl)-7-methyl-N-(2-methylheptan-2-yl)imidazo[1,2-a]pyridin-3-amine (CID 11573398) is 2-(furan-3-yl)-7-methyl-N-(2-methylheptan-2-yl)imidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for 2-(furan-3-yl)-7-methyl-N-(2-methylheptan-2-yl)imidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for 2-(furan-3-yl)-7-methyl-N-(2-methylheptan-2-yl)imidazo[1,2-a]pyridin-3-amine is CCCCCC(C)(C)Nc1c(-c2ccoc2)nc2cc(C)ccn12.
What is the InChIKey of 2-(furan-3-yl)-7-methyl-N-(2-methylheptan-2-yl)imidazo[1,2-a]pyridin-3-amine?
The InChIKey is ORCIECZQEHJZGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N3O/c1-5-6-7-10-20(3,4)22-19-18(16-9-12-24-14-16)21-17-13-15(2)8-11-23(17)19/h8-9,11-14,22H,5-7,10H2,1-4H3.
What are the key properties of 2-(furan-3-yl)-7-methyl-N-(2-methylheptan-2-yl)imidazo[1,2-a]pyridin-3-amine?
2-(furan-3-yl)-7-methyl-N-(2-methylheptan-2-yl)imidazo[1,2-a]pyridin-3-amine has a molecular weight of 325.46 g/mol, XLogP of 5.67, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-3-yl)-7-methyl-N-(2-methylheptan-2-yl)imidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 11573398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).