2-[ethyl(methyl)amino]-N-[[4-[2-(methoxymethyl)pyrimidin-4-yl]-2-methylmorpholin-2-yl]methyl]acetamide

C17H29N5O3 — CID 167857909

IUPAC2-[ethyl(methyl)amino]-N-[[4-[2-(methoxymethyl)pyrimidin-4-yl]-2-methylmorpholin-2-yl]methyl]acetamide
SMILESCCN(C)CC(=O)NCC1(C)CN(c2ccnc(COC)n2)CCO1
InChIInChI=1S/C17H29N5O3/c1-5-21(3)10-16(23)19-12-17(2)13-22(8-9-25-17)15-6-7-18-14(20-15)11-24-4/h6-7H,5,8-13H2,1-4H3,(H,19,23)
InChIKeyUDSPROAMSZGHBO-UHFFFAOYSA-N
MW351.45 g/mol
LogP0.29
Rot. Bonds8

About 2-[ethyl(methyl)amino]-N-[[4-[2-(methoxymethyl)pyrimidin-4-yl]-2-methylmorpholin-2-yl]methyl]acetamide

2-[ethyl(methyl)amino]-N-[[4-[2-(methoxymethyl)pyrimidin-4-yl]-2-methylmorpholin-2-yl]methyl]acetamide (PubChem CID 167857909) has the molecular formula C17H29N5O3 and a molecular weight of 351.45 g/mol. Its IUPAC name is 2-[ethyl(methyl)amino]-N-[[4-[2-(methoxymethyl)pyrimidin-4-yl]-2-methylmorpholin-2-yl]methyl]acetamide.

Molecular Properties

Compound Name2-[ethyl(methyl)amino]-N-[[4-[2-(methoxymethyl)pyrimidin-4-yl]-2-methylmorpholin-2-yl]methyl]acetamide
PubChem CID167857909
Molecular FormulaC17H29N5O3
Molecular Weight351.45 g/mol
Exact Mass351.23
IUPAC Name2-[ethyl(methyl)amino]-N-[[4-[2-(methoxymethyl)pyrimidin-4-yl]-2-methylmorpholin-2-yl]methyl]acetamide
SMILESCCN(C)CC(=O)NCC1(C)CN(c2ccnc(COC)n2)CCO1
InChIInChI=1S/C17H29N5O3/c1-5-21(3)10-16(23)19-12-17(2)13-22(8-9-25-17)15-6-7-18-14(20-15)11-24-4/h6-7H,5,8-13H2,1-4H3,(H,19,23)
InChIKeyUDSPROAMSZGHBO-UHFFFAOYSA-N
XLogP0.29
TPSA79.82 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.45
LogP ≤ 50.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-[[4-(6-ethoxy-2-methylpyrimidin-4-yl)-2-methylmorpholin-2-yl]methyl]-5,5-dimethylhexanamide
CID 138049196
2-(methoxymethyl)-4-(4-pyrazin-2-ylpiperazin-1-yl)pyrimidine
CID 10869888
N-[[4-(1,3-benzoxazol-2-yl)-2-methylmorpholin-2-yl]methyl]-2-methylpyridine-4-carboxamide
CID 138049229
N-[(4-pyrrolidin-1-ylpyrimidin-2-yl)methyl]propanamide
CID 121137119
(3aR,6aS)-3-[1-[2-(methoxymethyl)pyrimidin-4-yl]piperidin-4-yl]-5-propanoyl-3a,4,6,6a-tetrahydropyrrolo[3,4-d][1,3]oxazol-2-one
CID 167953082
2,2,3-trimethyl-N-[[2-methyl-4-[4-(trifluoromethyl)pyrimidin-2-yl]morpholin-2-yl]methyl]butanamide
CID 154784022
N-[(4-morpholin-4-ylpyrimidin-2-yl)methyl]pentanamide
CID 72718087
(2R)-2-ethyl-2-methyl-4-(4-methyl-2-pyridinyl)morpholine
CID 125138316
2-methyl-N-[(4-morpholin-4-ylpyrimidin-2-yl)methyl]propanamide
CID 72718086
2-fluoro-3-methyl-N-[[2-methyl-4-(6-methyl-2-pyridin-4-ylpyrimidin-4-yl)morpholin-2-yl]methyl]but-2-enamide
CID 154784273
3-methoxy-1-methyl-N-[(4-morpholin-4-ylpyrimidin-2-yl)methyl]pyrazole-4-carboxamide
CID 122318787
1-[2-(dimethylamino)pyrimidin-4-yl]-3-propylpyrrolidine-3-carboxylic acid
CID 64829459

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl(methyl)amino]-N-[[4-[2-(methoxymethyl)pyrimidin-4-yl]-2-methylmorpholin-2-yl]methyl]acetamide?
The IUPAC name of 2-[ethyl(methyl)amino]-N-[[4-[2-(methoxymethyl)pyrimidin-4-yl]-2-methylmorpholin-2-yl]methyl]acetamide (CID 167857909) is 2-[ethyl(methyl)amino]-N-[[4-[2-(methoxymethyl)pyrimidin-4-yl]-2-methylmorpholin-2-yl]methyl]acetamide.
What is the SMILES notation for 2-[ethyl(methyl)amino]-N-[[4-[2-(methoxymethyl)pyrimidin-4-yl]-2-methylmorpholin-2-yl]methyl]acetamide?
The canonical SMILES for 2-[ethyl(methyl)amino]-N-[[4-[2-(methoxymethyl)pyrimidin-4-yl]-2-methylmorpholin-2-yl]methyl]acetamide is CCN(C)CC(=O)NCC1(C)CN(c2ccnc(COC)n2)CCO1.
What is the InChIKey of 2-[ethyl(methyl)amino]-N-[[4-[2-(methoxymethyl)pyrimidin-4-yl]-2-methylmorpholin-2-yl]methyl]acetamide?
The InChIKey is UDSPROAMSZGHBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29N5O3/c1-5-21(3)10-16(23)19-12-17(2)13-22(8-9-25-17)15-6-7-18-14(20-15)11-24-4/h6-7H,5,8-13H2,1-4H3,(H,19,23).
What are the key properties of 2-[ethyl(methyl)amino]-N-[[4-[2-(methoxymethyl)pyrimidin-4-yl]-2-methylmorpholin-2-yl]methyl]acetamide?
2-[ethyl(methyl)amino]-N-[[4-[2-(methoxymethyl)pyrimidin-4-yl]-2-methylmorpholin-2-yl]methyl]acetamide has a molecular weight of 351.45 g/mol, XLogP of 0.29, 8 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl(methyl)amino]-N-[[4-[2-(methoxymethyl)pyrimidin-4-yl]-2-methylmorpholin-2-yl]methyl]acetamide is sourced from PubChem (CID 167857909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).