2,5-dimethyl-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]furan-3-carboxamide

C21H23N5O3 — CID 122355081

IUPAC2,5-dimethyl-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]furan-3-carboxamide
SMILESCc1cc(C(=O)Nc2ccc(Nc3cc(N4CCOCC4)cnn3)cc2)c(C)o1
InChIInChI=1S/C21H23N5O3/c1-14-11-19(15(2)29-14)21(27)24-17-5-3-16(4-6-17)23-20-12-18(13-22-25-20)26-7-9-28-10-8-26/h3-6,11-13H,7-10H2,1-2H3,(H,23,25)(H,24,27)
InChIKeyQXWBLNVWFNUVER-UHFFFAOYSA-N
MW393.45 g/mol
LogP3.52
Rot. Bonds5

About 2,5-dimethyl-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]furan-3-carboxamide

2,5-dimethyl-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]furan-3-carboxamide (PubChem CID 122355081) has the molecular formula C21H23N5O3 and a molecular weight of 393.45 g/mol. Its IUPAC name is 2,5-dimethyl-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]furan-3-carboxamide.

Molecular Properties

Compound Name2,5-dimethyl-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]furan-3-carboxamide
PubChem CID122355081
Molecular FormulaC21H23N5O3
Molecular Weight393.45 g/mol
Exact Mass393.18
IUPAC Name2,5-dimethyl-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]furan-3-carboxamide
SMILESCc1cc(C(=O)Nc2ccc(Nc3cc(N4CCOCC4)cnn3)cc2)c(C)o1
InChIInChI=1S/C21H23N5O3/c1-14-11-19(15(2)29-14)21(27)24-17-5-3-16(4-6-17)23-20-12-18(13-22-25-20)26-7-9-28-10-8-26/h3-6,11-13H,7-10H2,1-2H3,(H,23,25)(H,24,27)
InChIKeyQXWBLNVWFNUVER-UHFFFAOYSA-N
XLogP3.52
TPSA92.52 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.45
LogP ≤ 53.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 2,5-dimethyl-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]furan-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

Related Compounds

2,4-dimethyl-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]benzamide
CID 122354908
2-bromo-5-methoxy-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]benzamide
CID 122355154
4-iodo-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]benzamide
CID 122355270
1-(4-methoxyphenyl)-3-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]urea
CID 122354960
3,5-dimethoxy-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]benzamide
CID 122354917
4-ethoxy-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]benzamide
CID 122354914
1-(3-chloro-4-methylphenyl)-3-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]urea
CID 122354963
N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]butanamide
CID 122354898
1-(4-ethoxyphenyl)-3-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]urea
CID 122354979
2,5-dimethyl-N-(4-pyrrolidin-1-ylphenyl)furan-3-carboxamide
CID 110862042
N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]pentanamide
CID 122354899
2-methyl-N-[4-[(5-pyrrolidin-1-ylpyridazin-3-yl)amino]phenyl]benzamide
CID 122354511

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]furan-3-carboxamide?
The IUPAC name of 2,5-dimethyl-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]furan-3-carboxamide (CID 122355081) is 2,5-dimethyl-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]furan-3-carboxamide.
What is the SMILES notation for 2,5-dimethyl-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]furan-3-carboxamide?
The canonical SMILES for 2,5-dimethyl-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]furan-3-carboxamide is Cc1cc(C(=O)Nc2ccc(Nc3cc(N4CCOCC4)cnn3)cc2)c(C)o1.
What is the InChIKey of 2,5-dimethyl-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]furan-3-carboxamide?
The InChIKey is QXWBLNVWFNUVER-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N5O3/c1-14-11-19(15(2)29-14)21(27)24-17-5-3-16(4-6-17)23-20-12-18(13-22-25-20)26-7-9-28-10-8-26/h3-6,11-13H,7-10H2,1-2H3,(H,23,25)(H,24,27).
What are the key properties of 2,5-dimethyl-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]furan-3-carboxamide?
2,5-dimethyl-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]furan-3-carboxamide has a molecular weight of 393.45 g/mol, XLogP of 3.52, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]furan-3-carboxamide is sourced from PubChem (CID 122355081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).