3,5-dimethyl-N-[2-oxo-2-[(5-pyridin-2-yl-1H-pyrazol-4-yl)amino]ethyl]benzamide

C19H19N5O2 — CID 86796993

IUPAC3,5-dimethyl-N-[2-oxo-2-[(5-pyridin-2-yl-1H-pyrazol-4-yl)amino]ethyl]benzamide
SMILESCc1cc(C)cc(C(=O)NCC(=O)Nc2cn[nH]c2-c2ccccn2)c1
InChIInChI=1S/C19H19N5O2/c1-12-7-13(2)9-14(8-12)19(26)21-11-17(25)23-16-10-22-24-18(16)15-5-3-4-6-20-15/h3-10H,11H2,1-2H3,(H,21,26)(H,22,24)(H,23,25)
InChIKeyHFYZQNKAZODTTC-UHFFFAOYSA-N
MW349.39 g/mol
LogP2.46
Rot. Bonds5

About 3,5-dimethyl-N-[2-oxo-2-[(5-pyridin-2-yl-1H-pyrazol-4-yl)amino]ethyl]benzamide

3,5-dimethyl-N-[2-oxo-2-[(5-pyridin-2-yl-1H-pyrazol-4-yl)amino]ethyl]benzamide (PubChem CID 86796993) has the molecular formula C19H19N5O2 and a molecular weight of 349.39 g/mol. Its IUPAC name is 3,5-dimethyl-N-[2-oxo-2-[(5-pyridin-2-yl-1H-pyrazol-4-yl)amino]ethyl]benzamide.

Molecular Properties

Compound Name3,5-dimethyl-N-[2-oxo-2-[(5-pyridin-2-yl-1H-pyrazol-4-yl)amino]ethyl]benzamide
PubChem CID86796993
Molecular FormulaC19H19N5O2
Molecular Weight349.39 g/mol
Exact Mass349.15
IUPAC Name3,5-dimethyl-N-[2-oxo-2-[(5-pyridin-2-yl-1H-pyrazol-4-yl)amino]ethyl]benzamide
SMILESCc1cc(C)cc(C(=O)NCC(=O)Nc2cn[nH]c2-c2ccccn2)c1
InChIInChI=1S/C19H19N5O2/c1-12-7-13(2)9-14(8-12)19(26)21-11-17(25)23-16-10-22-24-18(16)15-5-3-4-6-20-15/h3-10H,11H2,1-2H3,(H,21,26)(H,22,24)(H,23,25)
InChIKeyHFYZQNKAZODTTC-UHFFFAOYSA-N
XLogP2.46
TPSA99.77 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.39
LogP ≤ 52.46
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 3,5-dimethyl-N-[2-oxo-2-[(5-pyridin-2-yl-1H-pyrazol-4-yl)amino]ethyl]benzamide 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 3,5-dimethyl-N-[2-oxo-2-[(5-pyridin-2-yl-1H-pyrazol-4-yl)amino]ethyl]benzamide?
The IUPAC name of 3,5-dimethyl-N-[2-oxo-2-[(5-pyridin-2-yl-1H-pyrazol-4-yl)amino]ethyl]benzamide (CID 86796993) is 3,5-dimethyl-N-[2-oxo-2-[(5-pyridin-2-yl-1H-pyrazol-4-yl)amino]ethyl]benzamide.
What is the SMILES notation for 3,5-dimethyl-N-[2-oxo-2-[(5-pyridin-2-yl-1H-pyrazol-4-yl)amino]ethyl]benzamide?
The canonical SMILES for 3,5-dimethyl-N-[2-oxo-2-[(5-pyridin-2-yl-1H-pyrazol-4-yl)amino]ethyl]benzamide is Cc1cc(C)cc(C(=O)NCC(=O)Nc2cn[nH]c2-c2ccccn2)c1.
What is the InChIKey of 3,5-dimethyl-N-[2-oxo-2-[(5-pyridin-2-yl-1H-pyrazol-4-yl)amino]ethyl]benzamide?
The InChIKey is HFYZQNKAZODTTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N5O2/c1-12-7-13(2)9-14(8-12)19(26)21-11-17(25)23-16-10-22-24-18(16)15-5-3-4-6-20-15/h3-10H,11H2,1-2H3,(H,21,26)(H,22,24)(H,23,25).
What are the key properties of 3,5-dimethyl-N-[2-oxo-2-[(5-pyridin-2-yl-1H-pyrazol-4-yl)amino]ethyl]benzamide?
3,5-dimethyl-N-[2-oxo-2-[(5-pyridin-2-yl-1H-pyrazol-4-yl)amino]ethyl]benzamide has a molecular weight of 349.39 g/mol, XLogP of 2.46, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-N-[2-oxo-2-[(5-pyridin-2-yl-1H-pyrazol-4-yl)amino]ethyl]benzamide is sourced from PubChem (CID 86796993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).