N-[2-(1,8-dimethylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]-1-ethyl-3-azabicyclo[3.1.0]hexane-6-carboxamide

C20H28N4O — CID 123247051

IUPACN-[2-(1,8-dimethylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]-1-ethyl-3-azabicyclo[3.1.0]hexane-6-carboxamide
SMILESCCC12CNCC1C2C(=O)NC(C)(C)c1nc(C)c2c(C)cccn12
InChIInChI=1S/C20H28N4O/c1-6-20-11-21-10-14(20)15(20)17(25)23-19(4,5)18-22-13(3)16-12(2)8-7-9-24(16)18/h7-9,14-15,21H,6,10-11H2,1-5H3,(H,23,25)
InChIKeyPPYHCMGUNQCQBQ-UHFFFAOYSA-N
MW340.47 g/mol
LogP2.55
Rot. Bonds4

About N-[2-(1,8-dimethylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]-1-ethyl-3-azabicyclo[3.1.0]hexane-6-carboxamide

N-[2-(1,8-dimethylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]-1-ethyl-3-azabicyclo[3.1.0]hexane-6-carboxamide (PubChem CID 123247051) has the molecular formula C20H28N4O and a molecular weight of 340.47 g/mol. Its IUPAC name is N-[2-(1,8-dimethylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]-1-ethyl-3-azabicyclo[3.1.0]hexane-6-carboxamide.

Molecular Properties

Compound NameN-[2-(1,8-dimethylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]-1-ethyl-3-azabicyclo[3.1.0]hexane-6-carboxamide
PubChem CID123247051
Molecular FormulaC20H28N4O
Molecular Weight340.47 g/mol
Exact Mass340.23
IUPAC NameN-[2-(1,8-dimethylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]-1-ethyl-3-azabicyclo[3.1.0]hexane-6-carboxamide
SMILESCCC12CNCC1C2C(=O)NC(C)(C)c1nc(C)c2c(C)cccn12
InChIInChI=1S/C20H28N4O/c1-6-20-11-21-10-14(20)15(20)17(25)23-19(4,5)18-22-13(3)16-12(2)8-7-9-24(16)18/h7-9,14-15,21H,6,10-11H2,1-5H3,(H,23,25)
InChIKeyPPYHCMGUNQCQBQ-UHFFFAOYSA-N
XLogP2.55
TPSA58.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.47
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[2-(1,8-dimethylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]-1-ethyl-3-azabicyclo[3.1.0]hexane-6-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[2-(1,8-dimethylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]-1-ethyl-3-azabicyclo[3.1.0]hexane-6-carboxamide?
The IUPAC name of N-[2-(1,8-dimethylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]-1-ethyl-3-azabicyclo[3.1.0]hexane-6-carboxamide (CID 123247051) is N-[2-(1,8-dimethylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]-1-ethyl-3-azabicyclo[3.1.0]hexane-6-carboxamide.
What is the SMILES notation for N-[2-(1,8-dimethylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]-1-ethyl-3-azabicyclo[3.1.0]hexane-6-carboxamide?
The canonical SMILES for N-[2-(1,8-dimethylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]-1-ethyl-3-azabicyclo[3.1.0]hexane-6-carboxamide is CCC12CNCC1C2C(=O)NC(C)(C)c1nc(C)c2c(C)cccn12.
What is the InChIKey of N-[2-(1,8-dimethylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]-1-ethyl-3-azabicyclo[3.1.0]hexane-6-carboxamide?
The InChIKey is PPYHCMGUNQCQBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28N4O/c1-6-20-11-21-10-14(20)15(20)17(25)23-19(4,5)18-22-13(3)16-12(2)8-7-9-24(16)18/h7-9,14-15,21H,6,10-11H2,1-5H3,(H,23,25).
What are the key properties of N-[2-(1,8-dimethylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]-1-ethyl-3-azabicyclo[3.1.0]hexane-6-carboxamide?
N-[2-(1,8-dimethylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]-1-ethyl-3-azabicyclo[3.1.0]hexane-6-carboxamide has a molecular weight of 340.47 g/mol, XLogP of 2.55, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1,8-dimethylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]-1-ethyl-3-azabicyclo[3.1.0]hexane-6-carboxamide is sourced from PubChem (CID 123247051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).