N-[(4-methoxyphenyl)methyl]-2-methyl-N-(oxolan-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide

C22H25N3O3 — CID 70730348

IUPACN-[(4-methoxyphenyl)methyl]-2-methyl-N-(oxolan-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide
SMILESCOc1ccc(CN(CC2CCCO2)C(=O)c2ccc3nc(C)cn3c2)cc1
InChIInChI=1S/C22H25N3O3/c1-16-12-24-14-18(7-10-21(24)23-16)22(26)25(15-20-4-3-11-28-20)13-17-5-8-19(27-2)9-6-17/h5-10,12,14,20H,3-4,11,13,15H2,1-2H3
InChIKeyRHVYNFYMNOWKGN-UHFFFAOYSA-N
MW379.46 g/mol
LogP3.47
Rot. Bonds6

About N-[(4-methoxyphenyl)methyl]-2-methyl-N-(oxolan-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide

N-[(4-methoxyphenyl)methyl]-2-methyl-N-(oxolan-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide (PubChem CID 70730348) has the molecular formula C22H25N3O3 and a molecular weight of 379.46 g/mol. Its IUPAC name is N-[(4-methoxyphenyl)methyl]-2-methyl-N-(oxolan-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide.

Molecular Properties

Compound NameN-[(4-methoxyphenyl)methyl]-2-methyl-N-(oxolan-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide
PubChem CID70730348
Molecular FormulaC22H25N3O3
Molecular Weight379.46 g/mol
Exact Mass379.19
IUPAC NameN-[(4-methoxyphenyl)methyl]-2-methyl-N-(oxolan-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide
SMILESCOc1ccc(CN(CC2CCCO2)C(=O)c2ccc3nc(C)cn3c2)cc1
InChIInChI=1S/C22H25N3O3/c1-16-12-24-14-18(7-10-21(24)23-16)22(26)25(15-20-4-3-11-28-20)13-17-5-8-19(27-2)9-6-17/h5-10,12,14,20H,3-4,11,13,15H2,1-2H3
InChIKeyRHVYNFYMNOWKGN-UHFFFAOYSA-N
XLogP3.47
TPSA56.07 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.46
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[(4-methoxyphenyl)methyl]-2-methyl-N-(oxolan-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide?
The IUPAC name of N-[(4-methoxyphenyl)methyl]-2-methyl-N-(oxolan-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide (CID 70730348) is N-[(4-methoxyphenyl)methyl]-2-methyl-N-(oxolan-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide.
What is the SMILES notation for N-[(4-methoxyphenyl)methyl]-2-methyl-N-(oxolan-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide?
The canonical SMILES for N-[(4-methoxyphenyl)methyl]-2-methyl-N-(oxolan-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide is COc1ccc(CN(CC2CCCO2)C(=O)c2ccc3nc(C)cn3c2)cc1.
What is the InChIKey of N-[(4-methoxyphenyl)methyl]-2-methyl-N-(oxolan-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide?
The InChIKey is RHVYNFYMNOWKGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N3O3/c1-16-12-24-14-18(7-10-21(24)23-16)22(26)25(15-20-4-3-11-28-20)13-17-5-8-19(27-2)9-6-17/h5-10,12,14,20H,3-4,11,13,15H2,1-2H3.
What are the key properties of N-[(4-methoxyphenyl)methyl]-2-methyl-N-(oxolan-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide?
N-[(4-methoxyphenyl)methyl]-2-methyl-N-(oxolan-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide has a molecular weight of 379.46 g/mol, XLogP of 3.47, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methoxyphenyl)methyl]-2-methyl-N-(oxolan-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide is sourced from PubChem (CID 70730348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).