8-(cyclobutylmethoxy)-N-[2-(1-hydroxycyclohexyl)ethyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide

C22H31N3O3 — CID 90115533

IUPAC8-(cyclobutylmethoxy)-N-[2-(1-hydroxycyclohexyl)ethyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1nc2c(OCC3CCC3)cccn2c1C(=O)NCCC1(O)CCCCC1
InChIInChI=1S/C22H31N3O3/c1-16-19(21(26)23-13-12-22(27)10-3-2-4-11-22)25-14-6-9-18(20(25)24-16)28-15-17-7-5-8-17/h6,9,14,17,27H,2-5,7-8,10-13,15H2,1H3,(H,23,26)
InChIKeyOXCKTZZVMVEXCM-UHFFFAOYSA-N
MW385.51 g/mol
LogP3.64
Rot. Bonds7

About 8-(cyclobutylmethoxy)-N-[2-(1-hydroxycyclohexyl)ethyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide

8-(cyclobutylmethoxy)-N-[2-(1-hydroxycyclohexyl)ethyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 90115533) has the molecular formula C22H31N3O3 and a molecular weight of 385.51 g/mol. Its IUPAC name is 8-(cyclobutylmethoxy)-N-[2-(1-hydroxycyclohexyl)ethyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name8-(cyclobutylmethoxy)-N-[2-(1-hydroxycyclohexyl)ethyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide
PubChem CID90115533
Molecular FormulaC22H31N3O3
Molecular Weight385.51 g/mol
Exact Mass385.24
IUPAC Name8-(cyclobutylmethoxy)-N-[2-(1-hydroxycyclohexyl)ethyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1nc2c(OCC3CCC3)cccn2c1C(=O)NCCC1(O)CCCCC1
InChIInChI=1S/C22H31N3O3/c1-16-19(21(26)23-13-12-22(27)10-3-2-4-11-22)25-14-6-9-18(20(25)24-16)28-15-17-7-5-8-17/h6,9,14,17,27H,2-5,7-8,10-13,15H2,1H3,(H,23,26)
InChIKeyOXCKTZZVMVEXCM-UHFFFAOYSA-N
XLogP3.64
TPSA75.86 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.51
LogP ≤ 53.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 8-(cyclobutylmethoxy)-N-[2-(1-hydroxycyclohexyl)ethyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of 8-(cyclobutylmethoxy)-N-[2-(1-hydroxycyclohexyl)ethyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide (CID 90115533) is 8-(cyclobutylmethoxy)-N-[2-(1-hydroxycyclohexyl)ethyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for 8-(cyclobutylmethoxy)-N-[2-(1-hydroxycyclohexyl)ethyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for 8-(cyclobutylmethoxy)-N-[2-(1-hydroxycyclohexyl)ethyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide is Cc1nc2c(OCC3CCC3)cccn2c1C(=O)NCCC1(O)CCCCC1.
What is the InChIKey of 8-(cyclobutylmethoxy)-N-[2-(1-hydroxycyclohexyl)ethyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is OXCKTZZVMVEXCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H31N3O3/c1-16-19(21(26)23-13-12-22(27)10-3-2-4-11-22)25-14-6-9-18(20(25)24-16)28-15-17-7-5-8-17/h6,9,14,17,27H,2-5,7-8,10-13,15H2,1H3,(H,23,26).
What are the key properties of 8-(cyclobutylmethoxy)-N-[2-(1-hydroxycyclohexyl)ethyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide?
8-(cyclobutylmethoxy)-N-[2-(1-hydroxycyclohexyl)ethyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 385.51 g/mol, XLogP of 3.64, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(cyclobutylmethoxy)-N-[2-(1-hydroxycyclohexyl)ethyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 90115533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).