N-(4,4-dimethyl-6,7-dihydro-5H-pyrazolo[1,5-a]pyridin-2-yl)-2-methylprop-2-enamide

C13H19N3O — CID 90927868

IUPACN-(4,4-dimethyl-6,7-dihydro-5H-pyrazolo[1,5-a]pyridin-2-yl)-2-methylprop-2-enamide
SMILESC=C(C)C(=O)Nc1cc2n(n1)CCCC2(C)C
InChIInChI=1S/C13H19N3O/c1-9(2)12(17)14-11-8-10-13(3,4)6-5-7-16(10)15-11/h8H,1,5-7H2,2-4H3,(H,14,15,17)
InChIKeyMGEPXMULCRBVBA-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.47
Rot. Bonds2

About N-(4,4-dimethyl-6,7-dihydro-5H-pyrazolo[1,5-a]pyridin-2-yl)-2-methylprop-2-enamide

N-(4,4-dimethyl-6,7-dihydro-5H-pyrazolo[1,5-a]pyridin-2-yl)-2-methylprop-2-enamide (PubChem CID 90927868) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is N-(4,4-dimethyl-6,7-dihydro-5H-pyrazolo[1,5-a]pyridin-2-yl)-2-methylprop-2-enamide.

Molecular Properties

Compound NameN-(4,4-dimethyl-6,7-dihydro-5H-pyrazolo[1,5-a]pyridin-2-yl)-2-methylprop-2-enamide
PubChem CID90927868
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC NameN-(4,4-dimethyl-6,7-dihydro-5H-pyrazolo[1,5-a]pyridin-2-yl)-2-methylprop-2-enamide
SMILESC=C(C)C(=O)Nc1cc2n(n1)CCCC2(C)C
InChIInChI=1S/C13H19N3O/c1-9(2)12(17)14-11-8-10-13(3,4)6-5-7-16(10)15-11/h8H,1,5-7H2,2-4H3,(H,14,15,17)
InChIKeyMGEPXMULCRBVBA-UHFFFAOYSA-N
XLogP2.47
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze N-(4,4-dimethyl-6,7-dihydro-5H-pyrazolo[1,5-a]pyridin-2-yl)-2-methylprop-2-enamide 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-(4,4-dimethyl-6,7-dihydro-5H-pyrazolo[1,5-a]pyridin-2-yl)-2-methylprop-2-enamide?
The IUPAC name of N-(4,4-dimethyl-6,7-dihydro-5H-pyrazolo[1,5-a]pyridin-2-yl)-2-methylprop-2-enamide (CID 90927868) is N-(4,4-dimethyl-6,7-dihydro-5H-pyrazolo[1,5-a]pyridin-2-yl)-2-methylprop-2-enamide.
What is the SMILES notation for N-(4,4-dimethyl-6,7-dihydro-5H-pyrazolo[1,5-a]pyridin-2-yl)-2-methylprop-2-enamide?
The canonical SMILES for N-(4,4-dimethyl-6,7-dihydro-5H-pyrazolo[1,5-a]pyridin-2-yl)-2-methylprop-2-enamide is C=C(C)C(=O)Nc1cc2n(n1)CCCC2(C)C.
What is the InChIKey of N-(4,4-dimethyl-6,7-dihydro-5H-pyrazolo[1,5-a]pyridin-2-yl)-2-methylprop-2-enamide?
The InChIKey is MGEPXMULCRBVBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c1-9(2)12(17)14-11-8-10-13(3,4)6-5-7-16(10)15-11/h8H,1,5-7H2,2-4H3,(H,14,15,17).
What are the key properties of N-(4,4-dimethyl-6,7-dihydro-5H-pyrazolo[1,5-a]pyridin-2-yl)-2-methylprop-2-enamide?
N-(4,4-dimethyl-6,7-dihydro-5H-pyrazolo[1,5-a]pyridin-2-yl)-2-methylprop-2-enamide has a molecular weight of 233.31 g/mol, XLogP of 2.47, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,4-dimethyl-6,7-dihydro-5H-pyrazolo[1,5-a]pyridin-2-yl)-2-methylprop-2-enamide is sourced from PubChem (CID 90927868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).