N-cyclohexyl-N-(2-cyclohexyl-8-phenylmethoxyimidazo[1,2-a]pyridin-3-yl)acetamide

C28H35N3O2 — CID 22591916

IUPACN-cyclohexyl-N-(2-cyclohexyl-8-phenylmethoxyimidazo[1,2-a]pyridin-3-yl)acetamide
SMILESCC(=O)N(c1c(C2CCCCC2)nc2c(OCc3ccccc3)cccn12)C1CCCCC1
InChIInChI=1S/C28H35N3O2/c1-21(32)31(24-16-9-4-10-17-24)28-26(23-14-7-3-8-15-23)29-27-25(18-11-19-30(27)28)33-20-22-12-5-2-6-13-22/h2,5-6,11-13,18-19,23-24H,3-4,7-10,14-17,20H2,1H3
InChIKeyFUASHRQTGWSFGV-UHFFFAOYSA-N
MW445.61 g/mol
LogP6.65
Rot. Bonds6

About N-cyclohexyl-N-(2-cyclohexyl-8-phenylmethoxyimidazo[1,2-a]pyridin-3-yl)acetamide

N-cyclohexyl-N-(2-cyclohexyl-8-phenylmethoxyimidazo[1,2-a]pyridin-3-yl)acetamide (PubChem CID 22591916) has the molecular formula C28H35N3O2 and a molecular weight of 445.61 g/mol. Its IUPAC name is N-cyclohexyl-N-(2-cyclohexyl-8-phenylmethoxyimidazo[1,2-a]pyridin-3-yl)acetamide.

Molecular Properties

Compound NameN-cyclohexyl-N-(2-cyclohexyl-8-phenylmethoxyimidazo[1,2-a]pyridin-3-yl)acetamide
PubChem CID22591916
Molecular FormulaC28H35N3O2
Molecular Weight445.61 g/mol
Exact Mass445.27
IUPAC NameN-cyclohexyl-N-(2-cyclohexyl-8-phenylmethoxyimidazo[1,2-a]pyridin-3-yl)acetamide
SMILESCC(=O)N(c1c(C2CCCCC2)nc2c(OCc3ccccc3)cccn12)C1CCCCC1
InChIInChI=1S/C28H35N3O2/c1-21(32)31(24-16-9-4-10-17-24)28-26(23-14-7-3-8-15-23)29-27-25(18-11-19-30(27)28)33-20-22-12-5-2-6-13-22/h2,5-6,11-13,18-19,23-24H,3-4,7-10,14-17,20H2,1H3
InChIKeyFUASHRQTGWSFGV-UHFFFAOYSA-N
XLogP6.65
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500445.61
LogP ≤ 56.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N-(2-cyclohexyl-8-phenylmethoxyimidazo[1,2-a]pyridin-3-yl)acetamide?
The IUPAC name of N-cyclohexyl-N-(2-cyclohexyl-8-phenylmethoxyimidazo[1,2-a]pyridin-3-yl)acetamide (CID 22591916) is N-cyclohexyl-N-(2-cyclohexyl-8-phenylmethoxyimidazo[1,2-a]pyridin-3-yl)acetamide.
What is the SMILES notation for N-cyclohexyl-N-(2-cyclohexyl-8-phenylmethoxyimidazo[1,2-a]pyridin-3-yl)acetamide?
The canonical SMILES for N-cyclohexyl-N-(2-cyclohexyl-8-phenylmethoxyimidazo[1,2-a]pyridin-3-yl)acetamide is CC(=O)N(c1c(C2CCCCC2)nc2c(OCc3ccccc3)cccn12)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-N-(2-cyclohexyl-8-phenylmethoxyimidazo[1,2-a]pyridin-3-yl)acetamide?
The InChIKey is FUASHRQTGWSFGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H35N3O2/c1-21(32)31(24-16-9-4-10-17-24)28-26(23-14-7-3-8-15-23)29-27-25(18-11-19-30(27)28)33-20-22-12-5-2-6-13-22/h2,5-6,11-13,18-19,23-24H,3-4,7-10,14-17,20H2,1H3.
What are the key properties of N-cyclohexyl-N-(2-cyclohexyl-8-phenylmethoxyimidazo[1,2-a]pyridin-3-yl)acetamide?
N-cyclohexyl-N-(2-cyclohexyl-8-phenylmethoxyimidazo[1,2-a]pyridin-3-yl)acetamide has a molecular weight of 445.61 g/mol, XLogP of 6.65, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-(2-cyclohexyl-8-phenylmethoxyimidazo[1,2-a]pyridin-3-yl)acetamide is sourced from PubChem (CID 22591916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).