5-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-nitrosomethyl]bicyclo[2.2.1]heptan-2-ol

C18H21N3O2 — CID 155329569

IUPAC5-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-nitrosomethyl]bicyclo[2.2.1]heptan-2-ol
SMILESO=NC(c1c(C2CC2)ccc2cncn12)C1CC2CC1CC2O
InChIInChI=1S/C18H21N3O2/c22-16-7-11-5-12(16)6-15(11)17(20-23)18-14(10-1-2-10)4-3-13-8-19-9-21(13)18/h3-4,8-12,15-17,22H,1-2,5-7H2
InChIKeyOYUXYLGVXYMPFB-UHFFFAOYSA-N
MW311.38 g/mol
LogP3.43
Rot. Bonds4

About 5-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-nitrosomethyl]bicyclo[2.2.1]heptan-2-ol

5-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-nitrosomethyl]bicyclo[2.2.1]heptan-2-ol (PubChem CID 155329569) has the molecular formula C18H21N3O2 and a molecular weight of 311.38 g/mol. Its IUPAC name is 5-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-nitrosomethyl]bicyclo[2.2.1]heptan-2-ol.

Molecular Properties

Compound Name5-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-nitrosomethyl]bicyclo[2.2.1]heptan-2-ol
PubChem CID155329569
Molecular FormulaC18H21N3O2
Molecular Weight311.38 g/mol
Exact Mass311.16
IUPAC Name5-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-nitrosomethyl]bicyclo[2.2.1]heptan-2-ol
SMILESO=NC(c1c(C2CC2)ccc2cncn12)C1CC2CC1CC2O
InChIInChI=1S/C18H21N3O2/c22-16-7-11-5-12(16)6-15(11)17(20-23)18-14(10-1-2-10)4-3-13-8-19-9-21(13)18/h3-4,8-12,15-17,22H,1-2,5-7H2
InChIKeyOYUXYLGVXYMPFB-UHFFFAOYSA-N
XLogP3.43
TPSA66.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.38
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-nitrosomethyl]bicyclo[2.2.1]heptan-2-ol?
The IUPAC name of 5-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-nitrosomethyl]bicyclo[2.2.1]heptan-2-ol (CID 155329569) is 5-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-nitrosomethyl]bicyclo[2.2.1]heptan-2-ol.
What is the SMILES notation for 5-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-nitrosomethyl]bicyclo[2.2.1]heptan-2-ol?
The canonical SMILES for 5-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-nitrosomethyl]bicyclo[2.2.1]heptan-2-ol is O=NC(c1c(C2CC2)ccc2cncn12)C1CC2CC1CC2O.
What is the InChIKey of 5-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-nitrosomethyl]bicyclo[2.2.1]heptan-2-ol?
The InChIKey is OYUXYLGVXYMPFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O2/c22-16-7-11-5-12(16)6-15(11)17(20-23)18-14(10-1-2-10)4-3-13-8-19-9-21(13)18/h3-4,8-12,15-17,22H,1-2,5-7H2.
What are the key properties of 5-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-nitrosomethyl]bicyclo[2.2.1]heptan-2-ol?
5-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-nitrosomethyl]bicyclo[2.2.1]heptan-2-ol has a molecular weight of 311.38 g/mol, XLogP of 3.43, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-nitrosomethyl]bicyclo[2.2.1]heptan-2-ol is sourced from PubChem (CID 155329569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).