N-cyclopropyl-2-(4-methyl-1-oxophthalazin-2-yl)-N-(oxolan-3-ylmethyl)acetamide

C19H23N3O3 — CID 51080983

IUPACN-cyclopropyl-2-(4-methyl-1-oxophthalazin-2-yl)-N-(oxolan-3-ylmethyl)acetamide
SMILESCc1nn(CC(=O)N(CC2CCOC2)C2CC2)c(=O)c2ccccc12
InChIInChI=1S/C19H23N3O3/c1-13-16-4-2-3-5-17(16)19(24)22(20-13)11-18(23)21(15-6-7-15)10-14-8-9-25-12-14/h2-5,14-15H,6-12H2,1H3
InChIKeyMBVKLMNXBIKCAY-UHFFFAOYSA-N
MW341.41 g/mol
LogP1.73
Rot. Bonds5

About N-cyclopropyl-2-(4-methyl-1-oxophthalazin-2-yl)-N-(oxolan-3-ylmethyl)acetamide

N-cyclopropyl-2-(4-methyl-1-oxophthalazin-2-yl)-N-(oxolan-3-ylmethyl)acetamide (PubChem CID 51080983) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is N-cyclopropyl-2-(4-methyl-1-oxophthalazin-2-yl)-N-(oxolan-3-ylmethyl)acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-(4-methyl-1-oxophthalazin-2-yl)-N-(oxolan-3-ylmethyl)acetamide
PubChem CID51080983
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC NameN-cyclopropyl-2-(4-methyl-1-oxophthalazin-2-yl)-N-(oxolan-3-ylmethyl)acetamide
SMILESCc1nn(CC(=O)N(CC2CCOC2)C2CC2)c(=O)c2ccccc12
InChIInChI=1S/C19H23N3O3/c1-13-16-4-2-3-5-17(16)19(24)22(20-13)11-18(23)21(15-6-7-15)10-14-8-9-25-12-14/h2-5,14-15H,6-12H2,1H3
InChIKeyMBVKLMNXBIKCAY-UHFFFAOYSA-N
XLogP1.73
TPSA64.43 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 51.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze N-cyclopropyl-2-(4-methyl-1-oxophthalazin-2-yl)-N-(oxolan-3-ylmethyl)acetamide 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-cyclopropyl-2-(4-methyl-1-oxophthalazin-2-yl)-N-(oxolan-3-ylmethyl)acetamide?
The IUPAC name of N-cyclopropyl-2-(4-methyl-1-oxophthalazin-2-yl)-N-(oxolan-3-ylmethyl)acetamide (CID 51080983) is N-cyclopropyl-2-(4-methyl-1-oxophthalazin-2-yl)-N-(oxolan-3-ylmethyl)acetamide.
What is the SMILES notation for N-cyclopropyl-2-(4-methyl-1-oxophthalazin-2-yl)-N-(oxolan-3-ylmethyl)acetamide?
The canonical SMILES for N-cyclopropyl-2-(4-methyl-1-oxophthalazin-2-yl)-N-(oxolan-3-ylmethyl)acetamide is Cc1nn(CC(=O)N(CC2CCOC2)C2CC2)c(=O)c2ccccc12.
What is the InChIKey of N-cyclopropyl-2-(4-methyl-1-oxophthalazin-2-yl)-N-(oxolan-3-ylmethyl)acetamide?
The InChIKey is MBVKLMNXBIKCAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3/c1-13-16-4-2-3-5-17(16)19(24)22(20-13)11-18(23)21(15-6-7-15)10-14-8-9-25-12-14/h2-5,14-15H,6-12H2,1H3.
What are the key properties of N-cyclopropyl-2-(4-methyl-1-oxophthalazin-2-yl)-N-(oxolan-3-ylmethyl)acetamide?
N-cyclopropyl-2-(4-methyl-1-oxophthalazin-2-yl)-N-(oxolan-3-ylmethyl)acetamide has a molecular weight of 341.41 g/mol, XLogP of 1.73, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-(4-methyl-1-oxophthalazin-2-yl)-N-(oxolan-3-ylmethyl)acetamide is sourced from PubChem (CID 51080983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).