N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]pentanamide

C19H25N5O2 — CID 122354899

IUPACN-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]pentanamide
SMILESCCCCC(=O)Nc1ccc(Nc2cc(N3CCOCC3)cnn2)cc1
InChIInChI=1S/C19H25N5O2/c1-2-3-4-19(25)22-16-7-5-15(6-8-16)21-18-13-17(14-20-23-18)24-9-11-26-12-10-24/h5-8,13-14H,2-4,9-12H2,1H3,(H,21,23)(H,22,25)
InChIKeyKKXHEEMLXCSNTI-UHFFFAOYSA-N
MW355.44 g/mol
LogP3.19
Rot. Bonds7

About N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]pentanamide

N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]pentanamide (PubChem CID 122354899) has the molecular formula C19H25N5O2 and a molecular weight of 355.44 g/mol. Its IUPAC name is N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]pentanamide.

Molecular Properties

Compound NameN-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]pentanamide
PubChem CID122354899
Molecular FormulaC19H25N5O2
Molecular Weight355.44 g/mol
Exact Mass355.20
IUPAC NameN-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]pentanamide
SMILESCCCCC(=O)Nc1ccc(Nc2cc(N3CCOCC3)cnn2)cc1
InChIInChI=1S/C19H25N5O2/c1-2-3-4-19(25)22-16-7-5-15(6-8-16)21-18-13-17(14-20-23-18)24-9-11-26-12-10-24/h5-8,13-14H,2-4,9-12H2,1H3,(H,21,23)(H,22,25)
InChIKeyKKXHEEMLXCSNTI-UHFFFAOYSA-N
XLogP3.19
TPSA79.38 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.44
LogP ≤ 53.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]butanamide
CID 122354898
N-(4-morpholin-4-ylphenyl)pentanamide
CID 2765048
1-(4-ethoxyphenyl)-3-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]urea
CID 122354979
1-(4-methoxyphenyl)-3-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]urea
CID 122354960
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
2-(1-methylindol-3-yl)-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]acetamide
CID 122355152
4-iodo-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]benzamide
CID 122355270
3,5-dimethoxy-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]benzamide
CID 122354917
2,4-dimethyl-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]benzamide
CID 122354908
2,5-dimethyl-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]furan-3-carboxamide
CID 122355081
1-(2,3-dimethylphenyl)-3-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]urea
CID 122354978

Frequently Asked Questions

What is the IUPAC name of N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]pentanamide?
The IUPAC name of N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]pentanamide (CID 122354899) is N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]pentanamide.
What is the SMILES notation for N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]pentanamide?
The canonical SMILES for N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]pentanamide is CCCCC(=O)Nc1ccc(Nc2cc(N3CCOCC3)cnn2)cc1.
What is the InChIKey of N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]pentanamide?
The InChIKey is KKXHEEMLXCSNTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5O2/c1-2-3-4-19(25)22-16-7-5-15(6-8-16)21-18-13-17(14-20-23-18)24-9-11-26-12-10-24/h5-8,13-14H,2-4,9-12H2,1H3,(H,21,23)(H,22,25).
What are the key properties of N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]pentanamide?
N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]pentanamide has a molecular weight of 355.44 g/mol, XLogP of 3.19, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]pentanamide is sourced from PubChem (CID 122354899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).