[3-nitroso-2-(4-propylphenyl)imidazo[1,2-a]pyridin-8-yl]methanol

C17H17N3O2 — CID 82356589

IUPAC[3-nitroso-2-(4-propylphenyl)imidazo[1,2-a]pyridin-8-yl]methanol
SMILESCCCc1ccc(-c2nc3c(CO)cccn3c2N=O)cc1
InChIInChI=1S/C17H17N3O2/c1-2-4-12-6-8-13(9-7-12)15-17(19-22)20-10-3-5-14(11-21)16(20)18-15/h3,5-10,21H,2,4,11H2,1H3
InChIKeyKOEVVMDYZSBDPS-UHFFFAOYSA-N
MW295.34 g/mol
LogP3.84
Rot. Bonds5

About [3-nitroso-2-(4-propylphenyl)imidazo[1,2-a]pyridin-8-yl]methanol

[3-nitroso-2-(4-propylphenyl)imidazo[1,2-a]pyridin-8-yl]methanol (PubChem CID 82356589) has the molecular formula C17H17N3O2 and a molecular weight of 295.34 g/mol. Its IUPAC name is [3-nitroso-2-(4-propylphenyl)imidazo[1,2-a]pyridin-8-yl]methanol.

Molecular Properties

Compound Name[3-nitroso-2-(4-propylphenyl)imidazo[1,2-a]pyridin-8-yl]methanol
PubChem CID82356589
Molecular FormulaC17H17N3O2
Molecular Weight295.34 g/mol
Exact Mass295.13
IUPAC Name[3-nitroso-2-(4-propylphenyl)imidazo[1,2-a]pyridin-8-yl]methanol
SMILESCCCc1ccc(-c2nc3c(CO)cccn3c2N=O)cc1
InChIInChI=1S/C17H17N3O2/c1-2-4-12-6-8-13(9-7-12)15-17(19-22)20-10-3-5-14(11-21)16(20)18-15/h3,5-10,21H,2,4,11H2,1H3
InChIKeyKOEVVMDYZSBDPS-UHFFFAOYSA-N
XLogP3.84
TPSA66.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.34
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [3-nitroso-2-(4-propylphenyl)imidazo[1,2-a]pyridin-8-yl]methanol?
The IUPAC name of [3-nitroso-2-(4-propylphenyl)imidazo[1,2-a]pyridin-8-yl]methanol (CID 82356589) is [3-nitroso-2-(4-propylphenyl)imidazo[1,2-a]pyridin-8-yl]methanol.
What is the SMILES notation for [3-nitroso-2-(4-propylphenyl)imidazo[1,2-a]pyridin-8-yl]methanol?
The canonical SMILES for [3-nitroso-2-(4-propylphenyl)imidazo[1,2-a]pyridin-8-yl]methanol is CCCc1ccc(-c2nc3c(CO)cccn3c2N=O)cc1.
What is the InChIKey of [3-nitroso-2-(4-propylphenyl)imidazo[1,2-a]pyridin-8-yl]methanol?
The InChIKey is KOEVVMDYZSBDPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O2/c1-2-4-12-6-8-13(9-7-12)15-17(19-22)20-10-3-5-14(11-21)16(20)18-15/h3,5-10,21H,2,4,11H2,1H3.
What are the key properties of [3-nitroso-2-(4-propylphenyl)imidazo[1,2-a]pyridin-8-yl]methanol?
[3-nitroso-2-(4-propylphenyl)imidazo[1,2-a]pyridin-8-yl]methanol has a molecular weight of 295.34 g/mol, XLogP of 3.84, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-nitroso-2-(4-propylphenyl)imidazo[1,2-a]pyridin-8-yl]methanol is sourced from PubChem (CID 82356589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).