N-benzyl-7,7-dimethyl-2-(methylamino)-5,8-dihydropyrano[4,3-b]pyridine-3-carboxamide

C19H23N3O2 — CID 909911

IUPACN-benzyl-7,7-dimethyl-2-(methylamino)-5,8-dihydropyrano[4,3-b]pyridine-3-carboxamide
SMILESCNc1nc2c(cc1C(=O)NCc1ccccc1)COC(C)(C)C2
InChIInChI=1S/C19H23N3O2/c1-19(2)10-16-14(12-24-19)9-15(17(20-3)22-16)18(23)21-11-13-7-5-4-6-8-13/h4-9H,10-12H2,1-3H3,(H,20,22)(H,21,23)
InChIKeyUNBWDGGHTULDHG-UHFFFAOYSA-N
MW325.41 g/mol
LogP2.90
Rot. Bonds4

About N-benzyl-7,7-dimethyl-2-(methylamino)-5,8-dihydropyrano[4,3-b]pyridine-3-carboxamide

N-benzyl-7,7-dimethyl-2-(methylamino)-5,8-dihydropyrano[4,3-b]pyridine-3-carboxamide (PubChem CID 909911) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is N-benzyl-7,7-dimethyl-2-(methylamino)-5,8-dihydropyrano[4,3-b]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-benzyl-7,7-dimethyl-2-(methylamino)-5,8-dihydropyrano[4,3-b]pyridine-3-carboxamide
PubChem CID909911
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC NameN-benzyl-7,7-dimethyl-2-(methylamino)-5,8-dihydropyrano[4,3-b]pyridine-3-carboxamide
SMILESCNc1nc2c(cc1C(=O)NCc1ccccc1)COC(C)(C)C2
InChIInChI=1S/C19H23N3O2/c1-19(2)10-16-14(12-24-19)9-15(17(20-3)22-16)18(23)21-11-13-7-5-4-6-8-13/h4-9H,10-12H2,1-3H3,(H,20,22)(H,21,23)
InChIKeyUNBWDGGHTULDHG-UHFFFAOYSA-N
XLogP2.90
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 52.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-benzyl-7,7-dimethyl-2-(methylamino)-5,8-dihydropyrano[4,3-b]pyridine-3-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-benzyl-7,7-dimethyl-2-(methylamino)-5,8-dihydropyrano[4,3-b]pyridine-3-carboxamide?
The IUPAC name of N-benzyl-7,7-dimethyl-2-(methylamino)-5,8-dihydropyrano[4,3-b]pyridine-3-carboxamide (CID 909911) is N-benzyl-7,7-dimethyl-2-(methylamino)-5,8-dihydropyrano[4,3-b]pyridine-3-carboxamide.
What is the SMILES notation for N-benzyl-7,7-dimethyl-2-(methylamino)-5,8-dihydropyrano[4,3-b]pyridine-3-carboxamide?
The canonical SMILES for N-benzyl-7,7-dimethyl-2-(methylamino)-5,8-dihydropyrano[4,3-b]pyridine-3-carboxamide is CNc1nc2c(cc1C(=O)NCc1ccccc1)COC(C)(C)C2.
What is the InChIKey of N-benzyl-7,7-dimethyl-2-(methylamino)-5,8-dihydropyrano[4,3-b]pyridine-3-carboxamide?
The InChIKey is UNBWDGGHTULDHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O2/c1-19(2)10-16-14(12-24-19)9-15(17(20-3)22-16)18(23)21-11-13-7-5-4-6-8-13/h4-9H,10-12H2,1-3H3,(H,20,22)(H,21,23).
What are the key properties of N-benzyl-7,7-dimethyl-2-(methylamino)-5,8-dihydropyrano[4,3-b]pyridine-3-carboxamide?
N-benzyl-7,7-dimethyl-2-(methylamino)-5,8-dihydropyrano[4,3-b]pyridine-3-carboxamide has a molecular weight of 325.41 g/mol, XLogP of 2.90, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-7,7-dimethyl-2-(methylamino)-5,8-dihydropyrano[4,3-b]pyridine-3-carboxamide is sourced from PubChem (CID 909911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).