5-[(2R)-2-[2-[(2-ethyl-6-methylpyrimidin-4-yl)amino]ethyl]morpholin-4-yl]-2-methylpyridazin-3-one

C18H26N6O2 — CID 95149287

IUPAC5-[(2R)-2-[2-[(2-ethyl-6-methylpyrimidin-4-yl)amino]ethyl]morpholin-4-yl]-2-methylpyridazin-3-one
SMILESCCc1nc(C)cc(NCC[C@@H]2CN(c3cnn(C)c(=O)c3)CCO2)n1
InChIInChI=1S/C18H26N6O2/c1-4-16-21-13(2)9-17(22-16)19-6-5-15-12-24(7-8-26-15)14-10-18(25)23(3)20-11-14/h9-11,15H,4-8,12H2,1-3H3,(H,19,21,22)/t15-/m1/s1
InChIKeyMPXLYBYHKMSYMM-OAHLLOKOSA-N
MW358.45 g/mol
LogP1.15
Rot. Bonds6

About 5-[(2R)-2-[2-[(2-ethyl-6-methylpyrimidin-4-yl)amino]ethyl]morpholin-4-yl]-2-methylpyridazin-3-one

5-[(2R)-2-[2-[(2-ethyl-6-methylpyrimidin-4-yl)amino]ethyl]morpholin-4-yl]-2-methylpyridazin-3-one (PubChem CID 95149287) has the molecular formula C18H26N6O2 and a molecular weight of 358.45 g/mol. Its IUPAC name is 5-[(2R)-2-[2-[(2-ethyl-6-methylpyrimidin-4-yl)amino]ethyl]morpholin-4-yl]-2-methylpyridazin-3-one.

Molecular Properties

Compound Name5-[(2R)-2-[2-[(2-ethyl-6-methylpyrimidin-4-yl)amino]ethyl]morpholin-4-yl]-2-methylpyridazin-3-one
PubChem CID95149287
Molecular FormulaC18H26N6O2
Molecular Weight358.45 g/mol
Exact Mass358.21
IUPAC Name5-[(2R)-2-[2-[(2-ethyl-6-methylpyrimidin-4-yl)amino]ethyl]morpholin-4-yl]-2-methylpyridazin-3-one
SMILESCCc1nc(C)cc(NCC[C@@H]2CN(c3cnn(C)c(=O)c3)CCO2)n1
InChIInChI=1S/C18H26N6O2/c1-4-16-21-13(2)9-17(22-16)19-6-5-15-12-24(7-8-26-15)14-10-18(25)23(3)20-11-14/h9-11,15H,4-8,12H2,1-3H3,(H,19,21,22)/t15-/m1/s1
InChIKeyMPXLYBYHKMSYMM-OAHLLOKOSA-N
XLogP1.15
TPSA85.17 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.45
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze 5-[(2R)-2-[2-[(2-ethyl-6-methylpyrimidin-4-yl)amino]ethyl]morpholin-4-yl]-2-methylpyridazin-3-one with MolForge

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Launch Full Analysis

Related Compounds

3-methyl-N-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]butanamide
CID 56913727
1-amino-N-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]cyclopropane-1-carboxamide;hydrochloride
CID 154895493
2-methyl-5-[(2R)-2-[2-(5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-ylamino)ethyl]morpholin-4-yl]pyridazin-3-one
CID 95216782
1-(3,5-dimethyl-1,2-oxazol-4-yl)-3-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]urea
CID 72941383
3-amino-N-[2-[4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]-1H-pyrazole-5-carboxamide
CID 56911085
N-[2-[(2R)-4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]-3-(tetrazol-1-yl)propanamide
CID 95711872
1-ethyl-N-[2-[(2S)-4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]pyrazole-3-carboxamide
CID 95709743
N,2-diethyl-6-(2-ethylmorpholin-4-yl)pyrimidin-4-amine
CID 80933708
6-chloro-2-ethyl-N-[2-(oxolan-2-yl)ethyl]pyrimidin-4-amine
CID 80936355
2-(4,6-dimethyl-2-oxopyrimidin-1-yl)-N-[[1-(1-methyl-6-oxopyridazin-4-yl)pyrrolidin-3-yl]methyl]acetamide
CID 70739773
2-[(2-ethyl-6-methylpyrimidin-4-yl)amino]-N-methylethanesulfonamide
CID 114276539
[4-[6-(ethylamino)-2-methylpyrimidin-4-yl]morpholin-2-yl]methanol
CID 81218197

Frequently Asked Questions

What is the IUPAC name of 5-[(2R)-2-[2-[(2-ethyl-6-methylpyrimidin-4-yl)amino]ethyl]morpholin-4-yl]-2-methylpyridazin-3-one?
The IUPAC name of 5-[(2R)-2-[2-[(2-ethyl-6-methylpyrimidin-4-yl)amino]ethyl]morpholin-4-yl]-2-methylpyridazin-3-one (CID 95149287) is 5-[(2R)-2-[2-[(2-ethyl-6-methylpyrimidin-4-yl)amino]ethyl]morpholin-4-yl]-2-methylpyridazin-3-one.
What is the SMILES notation for 5-[(2R)-2-[2-[(2-ethyl-6-methylpyrimidin-4-yl)amino]ethyl]morpholin-4-yl]-2-methylpyridazin-3-one?
The canonical SMILES for 5-[(2R)-2-[2-[(2-ethyl-6-methylpyrimidin-4-yl)amino]ethyl]morpholin-4-yl]-2-methylpyridazin-3-one is CCc1nc(C)cc(NCC[C@@H]2CN(c3cnn(C)c(=O)c3)CCO2)n1.
What is the InChIKey of 5-[(2R)-2-[2-[(2-ethyl-6-methylpyrimidin-4-yl)amino]ethyl]morpholin-4-yl]-2-methylpyridazin-3-one?
The InChIKey is MPXLYBYHKMSYMM-OAHLLOKOSA-N. The full InChI is InChI=1S/C18H26N6O2/c1-4-16-21-13(2)9-17(22-16)19-6-5-15-12-24(7-8-26-15)14-10-18(25)23(3)20-11-14/h9-11,15H,4-8,12H2,1-3H3,(H,19,21,22)/t15-/m1/s1.
What are the key properties of 5-[(2R)-2-[2-[(2-ethyl-6-methylpyrimidin-4-yl)amino]ethyl]morpholin-4-yl]-2-methylpyridazin-3-one?
5-[(2R)-2-[2-[(2-ethyl-6-methylpyrimidin-4-yl)amino]ethyl]morpholin-4-yl]-2-methylpyridazin-3-one has a molecular weight of 358.45 g/mol, XLogP of 1.15, 6 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2R)-2-[2-[(2-ethyl-6-methylpyrimidin-4-yl)amino]ethyl]morpholin-4-yl]-2-methylpyridazin-3-one is sourced from PubChem (CID 95149287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).