2-[methyl-[[(2R)-4-(6-piperidin-1-ylpyrimidin-4-yl)morpholin-2-yl]methyl]amino]acetamide

C17H28N6O2 — CID 125141326

IUPAC2-[methyl-[[(2R)-4-(6-piperidin-1-ylpyrimidin-4-yl)morpholin-2-yl]methyl]amino]acetamide
SMILESCN(CC(N)=O)C[C@@H]1CN(c2cc(N3CCCCC3)ncn2)CCO1
InChIInChI=1S/C17H28N6O2/c1-21(12-15(18)24)10-14-11-23(7-8-25-14)17-9-16(19-13-20-17)22-5-3-2-4-6-22/h9,13-14H,2-8,10-12H2,1H3,(H2,18,24)/t14-/m1/s1
InChIKeyCFLGLVICYXYLLH-CQSZACIVSA-N
MW348.45 g/mol
LogP0.09
Rot. Bonds6

About 2-[methyl-[[(2R)-4-(6-piperidin-1-ylpyrimidin-4-yl)morpholin-2-yl]methyl]amino]acetamide

2-[methyl-[[(2R)-4-(6-piperidin-1-ylpyrimidin-4-yl)morpholin-2-yl]methyl]amino]acetamide (PubChem CID 125141326) has the molecular formula C17H28N6O2 and a molecular weight of 348.45 g/mol. Its IUPAC name is 2-[methyl-[[(2R)-4-(6-piperidin-1-ylpyrimidin-4-yl)morpholin-2-yl]methyl]amino]acetamide.

Molecular Properties

Compound Name2-[methyl-[[(2R)-4-(6-piperidin-1-ylpyrimidin-4-yl)morpholin-2-yl]methyl]amino]acetamide
PubChem CID125141326
Molecular FormulaC17H28N6O2
Molecular Weight348.45 g/mol
Exact Mass348.23
IUPAC Name2-[methyl-[[(2R)-4-(6-piperidin-1-ylpyrimidin-4-yl)morpholin-2-yl]methyl]amino]acetamide
SMILESCN(CC(N)=O)C[C@@H]1CN(c2cc(N3CCCCC3)ncn2)CCO1
InChIInChI=1S/C17H28N6O2/c1-21(12-15(18)24)10-14-11-23(7-8-25-14)17-9-16(19-13-20-17)22-5-3-2-4-6-22/h9,13-14H,2-8,10-12H2,1H3,(H2,18,24)/t14-/m1/s1
InChIKeyCFLGLVICYXYLLH-CQSZACIVSA-N
XLogP0.09
TPSA87.82 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.45
LogP ≤ 50.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

2-[[(2S)-4-(6-amino-5-chloropyrimidin-4-yl)morpholin-2-yl]methyl-methylamino]acetamide
CID 125141490
2-[[4-(2-cyclopropylpyrimidin-4-yl)morpholin-2-yl]methyl-methylamino]acetamide
CID 128969399
2-[methyl-[[(2R)-4-[5-(trifluoromethyl)-1,3-thiazol-2-yl]morpholin-2-yl]methyl]amino]acetamide
CID 124875294
6-[2-[[(2-amino-2-oxoethyl)-methylamino]methyl]morpholin-4-yl]-5-chloro-N,N-dimethylpyridine-3-carboxamide
CID 126810031
2-[methyl-[[(2R)-4-(1-methylbenzimidazol-2-yl)morpholin-2-yl]methyl]amino]acetamide
CID 125141381
2-[[4-(3-ethyl-1,2,4-thiadiazol-5-yl)morpholin-2-yl]methyl-methylamino]acetamide
CID 128969383
2-[methyl-[[(2R)-4-(1,6-naphthyridin-4-yl)morpholin-2-yl]methyl]amino]acetamide
CID 124875126
2-[[(2R)-4-(3,8-dimethylquinolin-4-yl)morpholin-2-yl]methyl-methylamino]acetamide
CID 125141474
2-[(4-ethylsulfonylmorpholin-2-yl)methyl-methylamino]acetamide
CID 154739726
2-[[4-(2,6-dimethylpyrimidin-4-yl)morpholin-2-yl]methyl-methylamino]acetic acid
CID 120965265
2-[[(2S)-4-(cycloheptene-1-carbonyl)morpholin-2-yl]methyl-methylamino]acetamide
CID 129477993
2-[[4-(5-ethoxycarbonyl-2-pyridinyl)morpholin-2-yl]methyl-methylamino]acetic acid
CID 120965247

Frequently Asked Questions

What is the IUPAC name of 2-[methyl-[[(2R)-4-(6-piperidin-1-ylpyrimidin-4-yl)morpholin-2-yl]methyl]amino]acetamide?
The IUPAC name of 2-[methyl-[[(2R)-4-(6-piperidin-1-ylpyrimidin-4-yl)morpholin-2-yl]methyl]amino]acetamide (CID 125141326) is 2-[methyl-[[(2R)-4-(6-piperidin-1-ylpyrimidin-4-yl)morpholin-2-yl]methyl]amino]acetamide.
What is the SMILES notation for 2-[methyl-[[(2R)-4-(6-piperidin-1-ylpyrimidin-4-yl)morpholin-2-yl]methyl]amino]acetamide?
The canonical SMILES for 2-[methyl-[[(2R)-4-(6-piperidin-1-ylpyrimidin-4-yl)morpholin-2-yl]methyl]amino]acetamide is CN(CC(N)=O)C[C@@H]1CN(c2cc(N3CCCCC3)ncn2)CCO1.
What is the InChIKey of 2-[methyl-[[(2R)-4-(6-piperidin-1-ylpyrimidin-4-yl)morpholin-2-yl]methyl]amino]acetamide?
The InChIKey is CFLGLVICYXYLLH-CQSZACIVSA-N. The full InChI is InChI=1S/C17H28N6O2/c1-21(12-15(18)24)10-14-11-23(7-8-25-14)17-9-16(19-13-20-17)22-5-3-2-4-6-22/h9,13-14H,2-8,10-12H2,1H3,(H2,18,24)/t14-/m1/s1.
What are the key properties of 2-[methyl-[[(2R)-4-(6-piperidin-1-ylpyrimidin-4-yl)morpholin-2-yl]methyl]amino]acetamide?
2-[methyl-[[(2R)-4-(6-piperidin-1-ylpyrimidin-4-yl)morpholin-2-yl]methyl]amino]acetamide has a molecular weight of 348.45 g/mol, XLogP of 0.09, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl-[[(2R)-4-(6-piperidin-1-ylpyrimidin-4-yl)morpholin-2-yl]methyl]amino]acetamide is sourced from PubChem (CID 125141326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).