2-methyl-N-[8-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-yl]propanamide

C20H22N4O2 — CID 121379073

IUPAC2-methyl-N-[8-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-yl]propanamide
SMILESCC(C)C(=O)NC1COCc2c(-c3ccc4cnn(C)c4c3)cncc21
InChIInChI=1S/C20H22N4O2/c1-12(2)20(25)23-18-11-26-10-17-15(8-21-9-16(17)18)13-4-5-14-7-22-24(3)19(14)6-13/h4-9,12,18H,10-11H2,1-3H3,(H,23,25)
InChIKeyRWAZTINQHNBZGT-UHFFFAOYSA-N
MW350.42 g/mol
LogP2.98
Rot. Bonds3

About 2-methyl-N-[8-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-yl]propanamide

2-methyl-N-[8-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-yl]propanamide (PubChem CID 121379073) has the molecular formula C20H22N4O2 and a molecular weight of 350.42 g/mol. Its IUPAC name is 2-methyl-N-[8-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-yl]propanamide.

Molecular Properties

Compound Name2-methyl-N-[8-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-yl]propanamide
PubChem CID121379073
Molecular FormulaC20H22N4O2
Molecular Weight350.42 g/mol
Exact Mass350.17
IUPAC Name2-methyl-N-[8-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-yl]propanamide
SMILESCC(C)C(=O)NC1COCc2c(-c3ccc4cnn(C)c4c3)cncc21
InChIInChI=1S/C20H22N4O2/c1-12(2)20(25)23-18-11-26-10-17-15(8-21-9-16(17)18)13-4-5-14-7-22-24(3)19(14)6-13/h4-9,12,18H,10-11H2,1-3H3,(H,23,25)
InChIKeyRWAZTINQHNBZGT-UHFFFAOYSA-N
XLogP2.98
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.42
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-methyl-N-[8-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-yl]propanamide 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 2-methyl-N-[8-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-yl]propanamide?
The IUPAC name of 2-methyl-N-[8-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-yl]propanamide (CID 121379073) is 2-methyl-N-[8-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-yl]propanamide.
What is the SMILES notation for 2-methyl-N-[8-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-yl]propanamide?
The canonical SMILES for 2-methyl-N-[8-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-yl]propanamide is CC(C)C(=O)NC1COCc2c(-c3ccc4cnn(C)c4c3)cncc21.
What is the InChIKey of 2-methyl-N-[8-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-yl]propanamide?
The InChIKey is RWAZTINQHNBZGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O2/c1-12(2)20(25)23-18-11-26-10-17-15(8-21-9-16(17)18)13-4-5-14-7-22-24(3)19(14)6-13/h4-9,12,18H,10-11H2,1-3H3,(H,23,25).
What are the key properties of 2-methyl-N-[8-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-yl]propanamide?
2-methyl-N-[8-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-yl]propanamide has a molecular weight of 350.42 g/mol, XLogP of 2.98, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[8-(1-methylindazol-6-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-yl]propanamide is sourced from PubChem (CID 121379073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).