[4-[(2-methoxypyrimidin-5-yl)methyl]-2-methylmorpholin-2-yl]-morpholin-4-ylmethanone

C16H24N4O4 — CID 110268377

IUPAC[4-[(2-methoxypyrimidin-5-yl)methyl]-2-methylmorpholin-2-yl]-morpholin-4-ylmethanone
SMILESCOc1ncc(CN2CCOC(C)(C(=O)N3CCOCC3)C2)cn1
InChIInChI=1S/C16H24N4O4/c1-16(14(21)20-4-6-23-7-5-20)12-19(3-8-24-16)11-13-9-17-15(22-2)18-10-13/h9-10H,3-8,11-12H2,1-2H3
InChIKeyARZRISUQWDWAQO-UHFFFAOYSA-N
MW336.39 g/mol
LogP-0.07
Rot. Bonds4

About [4-[(2-methoxypyrimidin-5-yl)methyl]-2-methylmorpholin-2-yl]-morpholin-4-ylmethanone

[4-[(2-methoxypyrimidin-5-yl)methyl]-2-methylmorpholin-2-yl]-morpholin-4-ylmethanone (PubChem CID 110268377) has the molecular formula C16H24N4O4 and a molecular weight of 336.39 g/mol. Its IUPAC name is [4-[(2-methoxypyrimidin-5-yl)methyl]-2-methylmorpholin-2-yl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[4-[(2-methoxypyrimidin-5-yl)methyl]-2-methylmorpholin-2-yl]-morpholin-4-ylmethanone
PubChem CID110268377
Molecular FormulaC16H24N4O4
Molecular Weight336.39 g/mol
Exact Mass336.18
IUPAC Name[4-[(2-methoxypyrimidin-5-yl)methyl]-2-methylmorpholin-2-yl]-morpholin-4-ylmethanone
SMILESCOc1ncc(CN2CCOC(C)(C(=O)N3CCOCC3)C2)cn1
InChIInChI=1S/C16H24N4O4/c1-16(14(21)20-4-6-23-7-5-20)12-19(3-8-24-16)11-13-9-17-15(22-2)18-10-13/h9-10H,3-8,11-12H2,1-2H3
InChIKeyARZRISUQWDWAQO-UHFFFAOYSA-N
XLogP-0.07
TPSA77.02 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.39
LogP ≤ 5-0.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze [4-[(2-methoxypyrimidin-5-yl)methyl]-2-methylmorpholin-2-yl]-morpholin-4-ylmethanone 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

(2R*,6S*)-4-[(2-ethyl-5-pyrimidinyl)carbonyl]-2,6-dimethylmorpholine
CID 72861818
2-Methoxy-1-(4-pyrimidin-2-yl-1-oxa-4,9-diazaspiro[5.5]undecan-9-yl)ethanone
CID 97450999
2-Methyl-1-[4-(5-methylpyrimidin-2-yl)-1-oxa-4,8-diazaspiro[5.5]undecan-8-yl]propan-1-one
CID 118739023
(2-Methylmorpholin-2-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone
CID 118739931
1-[4-(5-Methylpyrimidin-2-yl)-1-oxa-4,8-diazaspiro[5.5]undecan-8-yl]ethanone
CID 118742796
N,N-dimethyl-2-[4-(5-methylpyrimidin-2-yl)-1-oxa-4,8-diazaspiro[5.5]undecan-8-yl]acetamide
CID 118745728
1-(4-Methylpiperazin-1-yl)-2-[(2-morpholin-4-ylpyrimidin-5-yl)methylamino]ethanone
CID 56799664
(2S)-4-[[2-(propylamino)pyrimidin-5-yl]methyl]morpholine-2-carboxamide
CID 99929770
2-Propoxy-1-[4-[5-(trifluoromethyl)pyrimidin-2-yl]piperazin-1-yl]ethanone
CID 167229126
2-Methoxy-1-[4-[5-(trifluoromethyl)pyrimidin-2-yl]piperazin-1-yl]propan-1-one
CID 169598936
Morpholin-2-yl-[4-[5-(trifluoromethyl)pyrimidin-2-yl]piperazin-1-yl]methanone
CID 171492951
tert-butyl (6R)-2,2-dimethyl-6-[4-[5-(trifluoromethyl)pyrimidin-2-yl]piperazine-1-carbonyl]morpholine-4-carboxylate
CID 171492958

Frequently Asked Questions

What is the IUPAC name of [4-[(2-methoxypyrimidin-5-yl)methyl]-2-methylmorpholin-2-yl]-morpholin-4-ylmethanone?
The IUPAC name of [4-[(2-methoxypyrimidin-5-yl)methyl]-2-methylmorpholin-2-yl]-morpholin-4-ylmethanone (CID 110268377) is [4-[(2-methoxypyrimidin-5-yl)methyl]-2-methylmorpholin-2-yl]-morpholin-4-ylmethanone.
What is the SMILES notation for [4-[(2-methoxypyrimidin-5-yl)methyl]-2-methylmorpholin-2-yl]-morpholin-4-ylmethanone?
The canonical SMILES for [4-[(2-methoxypyrimidin-5-yl)methyl]-2-methylmorpholin-2-yl]-morpholin-4-ylmethanone is COc1ncc(CN2CCOC(C)(C(=O)N3CCOCC3)C2)cn1.
What is the InChIKey of [4-[(2-methoxypyrimidin-5-yl)methyl]-2-methylmorpholin-2-yl]-morpholin-4-ylmethanone?
The InChIKey is ARZRISUQWDWAQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O4/c1-16(14(21)20-4-6-23-7-5-20)12-19(3-8-24-16)11-13-9-17-15(22-2)18-10-13/h9-10H,3-8,11-12H2,1-2H3.
What are the key properties of [4-[(2-methoxypyrimidin-5-yl)methyl]-2-methylmorpholin-2-yl]-morpholin-4-ylmethanone?
[4-[(2-methoxypyrimidin-5-yl)methyl]-2-methylmorpholin-2-yl]-morpholin-4-ylmethanone has a molecular weight of 336.39 g/mol, XLogP of -0.07, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(2-methoxypyrimidin-5-yl)methyl]-2-methylmorpholin-2-yl]-morpholin-4-ylmethanone is sourced from PubChem (CID 110268377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).