N-cyclohexyl-2-[(3,5-dimethoxybenzoyl)amino]-6-methylimidazo[1,2-a]pyridine-3-carboxamide

C24H28N4O4 — CID 155552121

IUPACN-cyclohexyl-2-[(3,5-dimethoxybenzoyl)amino]-6-methylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCOc1cc(OC)cc(C(=O)Nc2nc3ccc(C)cn3c2C(=O)NC2CCCCC2)c1
InChIInChI=1S/C24H28N4O4/c1-15-9-10-20-26-22(27-23(29)16-11-18(31-2)13-19(12-16)32-3)21(28(20)14-15)24(30)25-17-7-5-4-6-8-17/h9-14,17H,4-8H2,1-3H3,(H,25,30)(H,27,29)
InChIKeyPPQLSVDVQPLWLA-UHFFFAOYSA-N
MW436.51 g/mol
LogP3.97
Rot. Bonds6

About N-cyclohexyl-2-[(3,5-dimethoxybenzoyl)amino]-6-methylimidazo[1,2-a]pyridine-3-carboxamide

N-cyclohexyl-2-[(3,5-dimethoxybenzoyl)amino]-6-methylimidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 155552121) has the molecular formula C24H28N4O4 and a molecular weight of 436.51 g/mol. Its IUPAC name is N-cyclohexyl-2-[(3,5-dimethoxybenzoyl)amino]-6-methylimidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-2-[(3,5-dimethoxybenzoyl)amino]-6-methylimidazo[1,2-a]pyridine-3-carboxamide
PubChem CID155552121
Molecular FormulaC24H28N4O4
Molecular Weight436.51 g/mol
Exact Mass436.21
IUPAC NameN-cyclohexyl-2-[(3,5-dimethoxybenzoyl)amino]-6-methylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCOc1cc(OC)cc(C(=O)Nc2nc3ccc(C)cn3c2C(=O)NC2CCCCC2)c1
InChIInChI=1S/C24H28N4O4/c1-15-9-10-20-26-22(27-23(29)16-11-18(31-2)13-19(12-16)32-3)21(28(20)14-15)24(30)25-17-7-5-4-6-8-17/h9-14,17H,4-8H2,1-3H3,(H,25,30)(H,27,29)
InChIKeyPPQLSVDVQPLWLA-UHFFFAOYSA-N
XLogP3.97
TPSA93.96 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500436.51
LogP ≤ 53.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-[(3,5-dimethoxybenzoyl)amino]-6-methylimidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of N-cyclohexyl-2-[(3,5-dimethoxybenzoyl)amino]-6-methylimidazo[1,2-a]pyridine-3-carboxamide (CID 155552121) is N-cyclohexyl-2-[(3,5-dimethoxybenzoyl)amino]-6-methylimidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for N-cyclohexyl-2-[(3,5-dimethoxybenzoyl)amino]-6-methylimidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for N-cyclohexyl-2-[(3,5-dimethoxybenzoyl)amino]-6-methylimidazo[1,2-a]pyridine-3-carboxamide is COc1cc(OC)cc(C(=O)Nc2nc3ccc(C)cn3c2C(=O)NC2CCCCC2)c1.
What is the InChIKey of N-cyclohexyl-2-[(3,5-dimethoxybenzoyl)amino]-6-methylimidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is PPQLSVDVQPLWLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N4O4/c1-15-9-10-20-26-22(27-23(29)16-11-18(31-2)13-19(12-16)32-3)21(28(20)14-15)24(30)25-17-7-5-4-6-8-17/h9-14,17H,4-8H2,1-3H3,(H,25,30)(H,27,29).
What are the key properties of N-cyclohexyl-2-[(3,5-dimethoxybenzoyl)amino]-6-methylimidazo[1,2-a]pyridine-3-carboxamide?
N-cyclohexyl-2-[(3,5-dimethoxybenzoyl)amino]-6-methylimidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 436.51 g/mol, XLogP of 3.97, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-[(3,5-dimethoxybenzoyl)amino]-6-methylimidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 155552121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).