2-[[(2R)-4-(3-ethylpyridine-4-carbonyl)morpholin-2-yl]methyl-methylamino]acetamide

C16H24N4O3 — CID 129340878

IUPAC2-[[(2R)-4-(3-ethylpyridine-4-carbonyl)morpholin-2-yl]methyl-methylamino]acetamide
SMILESCCc1cnccc1C(=O)N1CCO[C@H](CN(C)CC(N)=O)C1
InChIInChI=1S/C16H24N4O3/c1-3-12-8-18-5-4-14(12)16(22)20-6-7-23-13(10-20)9-19(2)11-15(17)21/h4-5,8,13H,3,6-7,9-11H2,1-2H3,(H2,17,21)/t13-/m1/s1
InChIKeyQRWZQTHEZIJBBU-CYBMUJFWSA-N
MW320.39 g/mol
LogP-0.10
Rot. Bonds6

About 2-[[(2R)-4-(3-ethylpyridine-4-carbonyl)morpholin-2-yl]methyl-methylamino]acetamide

2-[[(2R)-4-(3-ethylpyridine-4-carbonyl)morpholin-2-yl]methyl-methylamino]acetamide (PubChem CID 129340878) has the molecular formula C16H24N4O3 and a molecular weight of 320.39 g/mol. Its IUPAC name is 2-[[(2R)-4-(3-ethylpyridine-4-carbonyl)morpholin-2-yl]methyl-methylamino]acetamide.

Molecular Properties

Compound Name2-[[(2R)-4-(3-ethylpyridine-4-carbonyl)morpholin-2-yl]methyl-methylamino]acetamide
PubChem CID129340878
Molecular FormulaC16H24N4O3
Molecular Weight320.39 g/mol
Exact Mass320.18
IUPAC Name2-[[(2R)-4-(3-ethylpyridine-4-carbonyl)morpholin-2-yl]methyl-methylamino]acetamide
SMILESCCc1cnccc1C(=O)N1CCO[C@H](CN(C)CC(N)=O)C1
InChIInChI=1S/C16H24N4O3/c1-3-12-8-18-5-4-14(12)16(22)20-6-7-23-13(10-20)9-19(2)11-15(17)21/h4-5,8,13H,3,6-7,9-11H2,1-2H3,(H2,17,21)/t13-/m1/s1
InChIKeyQRWZQTHEZIJBBU-CYBMUJFWSA-N
XLogP-0.10
TPSA88.76 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.39
LogP ≤ 5-0.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[[(2R)-4-(3-ethylpyridine-4-carbonyl)morpholin-2-yl]methyl-methylamino]acetamide?
The IUPAC name of 2-[[(2R)-4-(3-ethylpyridine-4-carbonyl)morpholin-2-yl]methyl-methylamino]acetamide (CID 129340878) is 2-[[(2R)-4-(3-ethylpyridine-4-carbonyl)morpholin-2-yl]methyl-methylamino]acetamide.
What is the SMILES notation for 2-[[(2R)-4-(3-ethylpyridine-4-carbonyl)morpholin-2-yl]methyl-methylamino]acetamide?
The canonical SMILES for 2-[[(2R)-4-(3-ethylpyridine-4-carbonyl)morpholin-2-yl]methyl-methylamino]acetamide is CCc1cnccc1C(=O)N1CCO[C@H](CN(C)CC(N)=O)C1.
What is the InChIKey of 2-[[(2R)-4-(3-ethylpyridine-4-carbonyl)morpholin-2-yl]methyl-methylamino]acetamide?
The InChIKey is QRWZQTHEZIJBBU-CYBMUJFWSA-N. The full InChI is InChI=1S/C16H24N4O3/c1-3-12-8-18-5-4-14(12)16(22)20-6-7-23-13(10-20)9-19(2)11-15(17)21/h4-5,8,13H,3,6-7,9-11H2,1-2H3,(H2,17,21)/t13-/m1/s1.
What are the key properties of 2-[[(2R)-4-(3-ethylpyridine-4-carbonyl)morpholin-2-yl]methyl-methylamino]acetamide?
2-[[(2R)-4-(3-ethylpyridine-4-carbonyl)morpholin-2-yl]methyl-methylamino]acetamide has a molecular weight of 320.39 g/mol, XLogP of -0.10, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(2R)-4-(3-ethylpyridine-4-carbonyl)morpholin-2-yl]methyl-methylamino]acetamide is sourced from PubChem (CID 129340878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).