2-(3-methylcyclohexyl)oxy-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethyl]propanamide

C19H31N3O2 — CID 56791501

IUPAC2-(3-methylcyclohexyl)oxy-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethyl]propanamide
SMILESCC1CCCC(OC(C)C(=O)NCCc2cn3c(n2)CCCC3)C1
InChIInChI=1S/C19H31N3O2/c1-14-6-5-7-17(12-14)24-15(2)19(23)20-10-9-16-13-22-11-4-3-8-18(22)21-16/h13-15,17H,3-12H2,1-2H3,(H,20,23)
InChIKeyYKMOMWMSJDFOCD-UHFFFAOYSA-N
MW333.48 g/mol
LogP2.86
Rot. Bonds6

About 2-(3-methylcyclohexyl)oxy-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethyl]propanamide

2-(3-methylcyclohexyl)oxy-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethyl]propanamide (PubChem CID 56791501) has the molecular formula C19H31N3O2 and a molecular weight of 333.48 g/mol. Its IUPAC name is 2-(3-methylcyclohexyl)oxy-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethyl]propanamide.

Molecular Properties

Compound Name2-(3-methylcyclohexyl)oxy-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethyl]propanamide
PubChem CID56791501
Molecular FormulaC19H31N3O2
Molecular Weight333.48 g/mol
Exact Mass333.24
IUPAC Name2-(3-methylcyclohexyl)oxy-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethyl]propanamide
SMILESCC1CCCC(OC(C)C(=O)NCCc2cn3c(n2)CCCC3)C1
InChIInChI=1S/C19H31N3O2/c1-14-6-5-7-17(12-14)24-15(2)19(23)20-10-9-16-13-22-11-4-3-8-18(22)21-16/h13-15,17H,3-12H2,1-2H3,(H,20,23)
InChIKeyYKMOMWMSJDFOCD-UHFFFAOYSA-N
XLogP2.86
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.48
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(3-methylcyclohexyl)oxy-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethyl]propanamide?
The IUPAC name of 2-(3-methylcyclohexyl)oxy-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethyl]propanamide (CID 56791501) is 2-(3-methylcyclohexyl)oxy-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethyl]propanamide.
What is the SMILES notation for 2-(3-methylcyclohexyl)oxy-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethyl]propanamide?
The canonical SMILES for 2-(3-methylcyclohexyl)oxy-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethyl]propanamide is CC1CCCC(OC(C)C(=O)NCCc2cn3c(n2)CCCC3)C1.
What is the InChIKey of 2-(3-methylcyclohexyl)oxy-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethyl]propanamide?
The InChIKey is YKMOMWMSJDFOCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H31N3O2/c1-14-6-5-7-17(12-14)24-15(2)19(23)20-10-9-16-13-22-11-4-3-8-18(22)21-16/h13-15,17H,3-12H2,1-2H3,(H,20,23).
What are the key properties of 2-(3-methylcyclohexyl)oxy-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethyl]propanamide?
2-(3-methylcyclohexyl)oxy-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethyl]propanamide has a molecular weight of 333.48 g/mol, XLogP of 2.86, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylcyclohexyl)oxy-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethyl]propanamide is sourced from PubChem (CID 56791501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).