N-cyclopropyl-2-(difluoromethoxy)-4-[7-[2-(dimethylamino)butoxy]imidazo[1,2-a]pyridin-3-yl]-6-methoxybenzamide

C25H30F2N4O4 — CID 146273238

IUPACN-cyclopropyl-2-(difluoromethoxy)-4-[7-[2-(dimethylamino)butoxy]imidazo[1,2-a]pyridin-3-yl]-6-methoxybenzamide
SMILESCCC(COc1ccn2c(-c3cc(OC)c(C(=O)NC4CC4)c(OC(F)F)c3)cnc2c1)N(C)C
InChIInChI=1S/C25H30F2N4O4/c1-5-17(30(2)3)14-34-18-8-9-31-19(13-28-22(31)12-18)15-10-20(33-4)23(21(11-15)35-25(26)27)24(32)29-16-6-7-16/h8-13,16-17,25H,5-7,14H2,1-4H3,(H,29,32)
InChIKeyARKVSJMCCKLFGA-UHFFFAOYSA-N
MW488.54 g/mol
LogP4.22
Rot. Bonds11

About N-cyclopropyl-2-(difluoromethoxy)-4-[7-[2-(dimethylamino)butoxy]imidazo[1,2-a]pyridin-3-yl]-6-methoxybenzamide

N-cyclopropyl-2-(difluoromethoxy)-4-[7-[2-(dimethylamino)butoxy]imidazo[1,2-a]pyridin-3-yl]-6-methoxybenzamide (PubChem CID 146273238) has the molecular formula C25H30F2N4O4 and a molecular weight of 488.54 g/mol. Its IUPAC name is N-cyclopropyl-2-(difluoromethoxy)-4-[7-[2-(dimethylamino)butoxy]imidazo[1,2-a]pyridin-3-yl]-6-methoxybenzamide.

Molecular Properties

Compound NameN-cyclopropyl-2-(difluoromethoxy)-4-[7-[2-(dimethylamino)butoxy]imidazo[1,2-a]pyridin-3-yl]-6-methoxybenzamide
PubChem CID146273238
Molecular FormulaC25H30F2N4O4
Molecular Weight488.54 g/mol
Exact Mass488.22
IUPAC NameN-cyclopropyl-2-(difluoromethoxy)-4-[7-[2-(dimethylamino)butoxy]imidazo[1,2-a]pyridin-3-yl]-6-methoxybenzamide
SMILESCCC(COc1ccn2c(-c3cc(OC)c(C(=O)NC4CC4)c(OC(F)F)c3)cnc2c1)N(C)C
InChIInChI=1S/C25H30F2N4O4/c1-5-17(30(2)3)14-34-18-8-9-31-19(13-28-22(31)12-18)15-10-20(33-4)23(21(11-15)35-25(26)27)24(32)29-16-6-7-16/h8-13,16-17,25H,5-7,14H2,1-4H3,(H,29,32)
InChIKeyARKVSJMCCKLFGA-UHFFFAOYSA-N
XLogP4.22
TPSA77.33 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds11
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500488.54
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-(difluoromethoxy)-4-[7-[2-(dimethylamino)butoxy]imidazo[1,2-a]pyridin-3-yl]-6-methoxybenzamide?
The IUPAC name of N-cyclopropyl-2-(difluoromethoxy)-4-[7-[2-(dimethylamino)butoxy]imidazo[1,2-a]pyridin-3-yl]-6-methoxybenzamide (CID 146273238) is N-cyclopropyl-2-(difluoromethoxy)-4-[7-[2-(dimethylamino)butoxy]imidazo[1,2-a]pyridin-3-yl]-6-methoxybenzamide.
What is the SMILES notation for N-cyclopropyl-2-(difluoromethoxy)-4-[7-[2-(dimethylamino)butoxy]imidazo[1,2-a]pyridin-3-yl]-6-methoxybenzamide?
The canonical SMILES for N-cyclopropyl-2-(difluoromethoxy)-4-[7-[2-(dimethylamino)butoxy]imidazo[1,2-a]pyridin-3-yl]-6-methoxybenzamide is CCC(COc1ccn2c(-c3cc(OC)c(C(=O)NC4CC4)c(OC(F)F)c3)cnc2c1)N(C)C.
What is the InChIKey of N-cyclopropyl-2-(difluoromethoxy)-4-[7-[2-(dimethylamino)butoxy]imidazo[1,2-a]pyridin-3-yl]-6-methoxybenzamide?
The InChIKey is ARKVSJMCCKLFGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H30F2N4O4/c1-5-17(30(2)3)14-34-18-8-9-31-19(13-28-22(31)12-18)15-10-20(33-4)23(21(11-15)35-25(26)27)24(32)29-16-6-7-16/h8-13,16-17,25H,5-7,14H2,1-4H3,(H,29,32).
What are the key properties of N-cyclopropyl-2-(difluoromethoxy)-4-[7-[2-(dimethylamino)butoxy]imidazo[1,2-a]pyridin-3-yl]-6-methoxybenzamide?
N-cyclopropyl-2-(difluoromethoxy)-4-[7-[2-(dimethylamino)butoxy]imidazo[1,2-a]pyridin-3-yl]-6-methoxybenzamide has a molecular weight of 488.54 g/mol, XLogP of 4.22, 11 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-(difluoromethoxy)-4-[7-[2-(dimethylamino)butoxy]imidazo[1,2-a]pyridin-3-yl]-6-methoxybenzamide is sourced from PubChem (CID 146273238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).