N-(2-methoxyethyl)-6-oxo-N-[(4-oxo-3H-quinazolin-2-yl)methyl]-1-propylpyridazine-3-carboxamide

C20H23N5O4 — CID 135877367

IUPACN-(2-methoxyethyl)-6-oxo-N-[(4-oxo-3H-quinazolin-2-yl)methyl]-1-propylpyridazine-3-carboxamide
SMILESCCCn1nc(C(=O)N(CCOC)Cc2nc3ccccc3c(=O)[nH]2)ccc1=O
InChIInChI=1S/C20H23N5O4/c1-3-10-25-18(26)9-8-16(23-25)20(28)24(11-12-29-2)13-17-21-15-7-5-4-6-14(15)19(27)22-17/h4-9H,3,10-13H2,1-2H3,(H,21,22,27)
InChIKeyFEBNYNBGSCQTGF-UHFFFAOYSA-N
MW397.44 g/mol
LogP1.18
Rot. Bonds8

About N-(2-methoxyethyl)-6-oxo-N-[(4-oxo-3H-quinazolin-2-yl)methyl]-1-propylpyridazine-3-carboxamide

N-(2-methoxyethyl)-6-oxo-N-[(4-oxo-3H-quinazolin-2-yl)methyl]-1-propylpyridazine-3-carboxamide (PubChem CID 135877367) has the molecular formula C20H23N5O4 and a molecular weight of 397.44 g/mol. Its IUPAC name is N-(2-methoxyethyl)-6-oxo-N-[(4-oxo-3H-quinazolin-2-yl)methyl]-1-propylpyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-6-oxo-N-[(4-oxo-3H-quinazolin-2-yl)methyl]-1-propylpyridazine-3-carboxamide
PubChem CID135877367
Molecular FormulaC20H23N5O4
Molecular Weight397.44 g/mol
Exact Mass397.18
IUPAC NameN-(2-methoxyethyl)-6-oxo-N-[(4-oxo-3H-quinazolin-2-yl)methyl]-1-propylpyridazine-3-carboxamide
SMILESCCCn1nc(C(=O)N(CCOC)Cc2nc3ccccc3c(=O)[nH]2)ccc1=O
InChIInChI=1S/C20H23N5O4/c1-3-10-25-18(26)9-8-16(23-25)20(28)24(11-12-29-2)13-17-21-15-7-5-4-6-14(15)19(27)22-17/h4-9H,3,10-13H2,1-2H3,(H,21,22,27)
InChIKeyFEBNYNBGSCQTGF-UHFFFAOYSA-N
XLogP1.18
TPSA110.18 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.44
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-(2-methoxyethyl)-6-oxo-N-[(4-oxo-3H-quinazolin-2-yl)methyl]-1-propylpyridazine-3-carboxamide with MolForge

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Related Compounds

N-(2-methoxyethyl)-N-[(4-oxo-3H-quinazolin-2-yl)methyl]quinoline-2-carboxamide
CID 135848512
N-(2-methoxyethyl)-N-[(4-oxo-3H-quinazolin-2-yl)methyl]quinoxaline-2-carboxamide
CID 135819529
N-(2-methoxyethyl)-2,5-dimethyl-N-[(4-oxo-3H-quinazolin-2-yl)methyl]furan-3-carboxamide
CID 135939332
N-(2-methoxyethyl)-3-methyl-N-[(4-oxo-3H-quinazolin-2-yl)methyl]thiophene-2-carboxamide
CID 135909619
3-chloro-N-(2-methoxyethyl)-N-[(4-oxo-3H-quinazolin-2-yl)methyl]benzamide
CID 135722249
N-(2-methoxyethyl)-N-[(4-oxo-3H-quinazolin-2-yl)methyl]-1-benzofuran-2-carboxamide
CID 135722240
5-chloro-2-fluoro-N-(2-methoxyethyl)-N-[(4-oxo-3H-quinazolin-2-yl)methyl]benzamide
CID 135842963
5-ethyl-N-(2-methoxyethyl)-4-methyl-N-[(4-oxo-3H-quinazolin-2-yl)methyl]thiophene-2-carboxamide
CID 135665198
N-(2-methoxyethyl)-3-(3-methyl-2-oxobenzimidazol-1-yl)-N-[(4-oxo-3H-quinazolin-2-yl)methyl]propanamide
CID 135737950
N-(2-methoxyethyl)-2-(3-methyl-2-oxobenzimidazol-1-yl)-N-[(4-oxo-3H-quinazolin-2-yl)methyl]acetamide
CID 135857679
2-(2-fluorophenyl)-N-(2-methoxyethyl)-N-[(4-oxo-3H-quinazolin-2-yl)methyl]acetamide
CID 135722281
N-(2-methoxyethyl)-2-(2-methoxyphenyl)-N-[(4-oxo-3H-quinazolin-2-yl)methyl]acetamide
CID 135665194

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-6-oxo-N-[(4-oxo-3H-quinazolin-2-yl)methyl]-1-propylpyridazine-3-carboxamide?
The IUPAC name of N-(2-methoxyethyl)-6-oxo-N-[(4-oxo-3H-quinazolin-2-yl)methyl]-1-propylpyridazine-3-carboxamide (CID 135877367) is N-(2-methoxyethyl)-6-oxo-N-[(4-oxo-3H-quinazolin-2-yl)methyl]-1-propylpyridazine-3-carboxamide.
What is the SMILES notation for N-(2-methoxyethyl)-6-oxo-N-[(4-oxo-3H-quinazolin-2-yl)methyl]-1-propylpyridazine-3-carboxamide?
The canonical SMILES for N-(2-methoxyethyl)-6-oxo-N-[(4-oxo-3H-quinazolin-2-yl)methyl]-1-propylpyridazine-3-carboxamide is CCCn1nc(C(=O)N(CCOC)Cc2nc3ccccc3c(=O)[nH]2)ccc1=O.
What is the InChIKey of N-(2-methoxyethyl)-6-oxo-N-[(4-oxo-3H-quinazolin-2-yl)methyl]-1-propylpyridazine-3-carboxamide?
The InChIKey is FEBNYNBGSCQTGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N5O4/c1-3-10-25-18(26)9-8-16(23-25)20(28)24(11-12-29-2)13-17-21-15-7-5-4-6-14(15)19(27)22-17/h4-9H,3,10-13H2,1-2H3,(H,21,22,27).
What are the key properties of N-(2-methoxyethyl)-6-oxo-N-[(4-oxo-3H-quinazolin-2-yl)methyl]-1-propylpyridazine-3-carboxamide?
N-(2-methoxyethyl)-6-oxo-N-[(4-oxo-3H-quinazolin-2-yl)methyl]-1-propylpyridazine-3-carboxamide has a molecular weight of 397.44 g/mol, XLogP of 1.18, 8 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-6-oxo-N-[(4-oxo-3H-quinazolin-2-yl)methyl]-1-propylpyridazine-3-carboxamide is sourced from PubChem (CID 135877367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).