6-(difluoromethyl)-N-[7-ethoxy-2-(1-methoxycyclopropyl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide

C20H20F2N4O3 — CID 154655565

IUPAC6-(difluoromethyl)-N-[7-ethoxy-2-(1-methoxycyclopropyl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide
SMILESCCOc1cc2nc(C3(OC)CC3)cn2cc1NC(=O)c1cccc(C(F)F)n1
InChIInChI=1S/C20H20F2N4O3/c1-3-29-15-9-17-25-16(20(28-2)7-8-20)11-26(17)10-14(15)24-19(27)13-6-4-5-12(23-13)18(21)22/h4-6,9-11,18H,3,7-8H2,1-2H3,(H,24,27)
InChIKeyXXVFPMARFVFJAD-UHFFFAOYSA-N
MW402.40 g/mol
LogP3.95
Rot. Bonds7

About 6-(difluoromethyl)-N-[7-ethoxy-2-(1-methoxycyclopropyl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide

6-(difluoromethyl)-N-[7-ethoxy-2-(1-methoxycyclopropyl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide (PubChem CID 154655565) has the molecular formula C20H20F2N4O3 and a molecular weight of 402.40 g/mol. Its IUPAC name is 6-(difluoromethyl)-N-[7-ethoxy-2-(1-methoxycyclopropyl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide.

Molecular Properties

Compound Name6-(difluoromethyl)-N-[7-ethoxy-2-(1-methoxycyclopropyl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide
PubChem CID154655565
Molecular FormulaC20H20F2N4O3
Molecular Weight402.40 g/mol
Exact Mass402.15
IUPAC Name6-(difluoromethyl)-N-[7-ethoxy-2-(1-methoxycyclopropyl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide
SMILESCCOc1cc2nc(C3(OC)CC3)cn2cc1NC(=O)c1cccc(C(F)F)n1
InChIInChI=1S/C20H20F2N4O3/c1-3-29-15-9-17-25-16(20(28-2)7-8-20)11-26(17)10-14(15)24-19(27)13-6-4-5-12(23-13)18(21)22/h4-6,9-11,18H,3,7-8H2,1-2H3,(H,24,27)
InChIKeyXXVFPMARFVFJAD-UHFFFAOYSA-N
XLogP3.95
TPSA77.75 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.40
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-(difluoromethyl)-N-[7-ethoxy-2-(1-methoxycyclopropyl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide?
The IUPAC name of 6-(difluoromethyl)-N-[7-ethoxy-2-(1-methoxycyclopropyl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide (CID 154655565) is 6-(difluoromethyl)-N-[7-ethoxy-2-(1-methoxycyclopropyl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide.
What is the SMILES notation for 6-(difluoromethyl)-N-[7-ethoxy-2-(1-methoxycyclopropyl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide?
The canonical SMILES for 6-(difluoromethyl)-N-[7-ethoxy-2-(1-methoxycyclopropyl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide is CCOc1cc2nc(C3(OC)CC3)cn2cc1NC(=O)c1cccc(C(F)F)n1.
What is the InChIKey of 6-(difluoromethyl)-N-[7-ethoxy-2-(1-methoxycyclopropyl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide?
The InChIKey is XXVFPMARFVFJAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20F2N4O3/c1-3-29-15-9-17-25-16(20(28-2)7-8-20)11-26(17)10-14(15)24-19(27)13-6-4-5-12(23-13)18(21)22/h4-6,9-11,18H,3,7-8H2,1-2H3,(H,24,27).
What are the key properties of 6-(difluoromethyl)-N-[7-ethoxy-2-(1-methoxycyclopropyl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide?
6-(difluoromethyl)-N-[7-ethoxy-2-(1-methoxycyclopropyl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide has a molecular weight of 402.40 g/mol, XLogP of 3.95, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(difluoromethyl)-N-[7-ethoxy-2-(1-methoxycyclopropyl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide is sourced from PubChem (CID 154655565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).