N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-(1-piperidin-1-ylethyl)furan-2-carboxamide

C21H26N4O2 — CID 118768622

IUPACN-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-(1-piperidin-1-ylethyl)furan-2-carboxamide
SMILESCc1cccn2cc(CNC(=O)c3ccc(C(C)N4CCCCC4)o3)nc12
InChIInChI=1S/C21H26N4O2/c1-15-7-6-12-25-14-17(23-20(15)25)13-22-21(26)19-9-8-18(27-19)16(2)24-10-4-3-5-11-24/h6-9,12,14,16H,3-5,10-11,13H2,1-2H3,(H,22,26)
InChIKeyKNWYMXJHWYCMLY-UHFFFAOYSA-N
MW366.47 g/mol
LogP3.71
Rot. Bonds5

About N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-(1-piperidin-1-ylethyl)furan-2-carboxamide

N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-(1-piperidin-1-ylethyl)furan-2-carboxamide (PubChem CID 118768622) has the molecular formula C21H26N4O2 and a molecular weight of 366.47 g/mol. Its IUPAC name is N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-(1-piperidin-1-ylethyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-(1-piperidin-1-ylethyl)furan-2-carboxamide
PubChem CID118768622
Molecular FormulaC21H26N4O2
Molecular Weight366.47 g/mol
Exact Mass366.21
IUPAC NameN-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-(1-piperidin-1-ylethyl)furan-2-carboxamide
SMILESCc1cccn2cc(CNC(=O)c3ccc(C(C)N4CCCCC4)o3)nc12
InChIInChI=1S/C21H26N4O2/c1-15-7-6-12-25-14-17(23-20(15)25)13-22-21(26)19-9-8-18(27-19)16(2)24-10-4-3-5-11-24/h6-9,12,14,16H,3-5,10-11,13H2,1-2H3,(H,22,26)
InChIKeyKNWYMXJHWYCMLY-UHFFFAOYSA-N
XLogP3.71
TPSA62.78 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.47
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-(1-piperidin-1-ylethyl)furan-2-carboxamide?
The IUPAC name of N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-(1-piperidin-1-ylethyl)furan-2-carboxamide (CID 118768622) is N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-(1-piperidin-1-ylethyl)furan-2-carboxamide.
What is the SMILES notation for N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-(1-piperidin-1-ylethyl)furan-2-carboxamide?
The canonical SMILES for N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-(1-piperidin-1-ylethyl)furan-2-carboxamide is Cc1cccn2cc(CNC(=O)c3ccc(C(C)N4CCCCC4)o3)nc12.
What is the InChIKey of N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-(1-piperidin-1-ylethyl)furan-2-carboxamide?
The InChIKey is KNWYMXJHWYCMLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N4O2/c1-15-7-6-12-25-14-17(23-20(15)25)13-22-21(26)19-9-8-18(27-19)16(2)24-10-4-3-5-11-24/h6-9,12,14,16H,3-5,10-11,13H2,1-2H3,(H,22,26).
What are the key properties of N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-(1-piperidin-1-ylethyl)furan-2-carboxamide?
N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-(1-piperidin-1-ylethyl)furan-2-carboxamide has a molecular weight of 366.47 g/mol, XLogP of 3.71, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-(1-piperidin-1-ylethyl)furan-2-carboxamide is sourced from PubChem (CID 118768622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).