N-[[(2S)-4-(1-ethylcyclohexanecarbonyl)morpholin-2-yl]methyl]acetamide

C16H28N2O3 — CID 164629930

IUPACN-[[(2S)-4-(1-ethylcyclohexanecarbonyl)morpholin-2-yl]methyl]acetamide
SMILESCCC1(C(=O)N2CCO[C@@H](CNC(C)=O)C2)CCCCC1
InChIInChI=1S/C16H28N2O3/c1-3-16(7-5-4-6-8-16)15(20)18-9-10-21-14(12-18)11-17-13(2)19/h14H,3-12H2,1-2H3,(H,17,19)/t14-/m0/s1
InChIKeyQIZJSRRVRZXHJG-AWEZNQCLSA-N
MW296.41 g/mol
LogP1.71
Rot. Bonds4

About N-[[(2S)-4-(1-ethylcyclohexanecarbonyl)morpholin-2-yl]methyl]acetamide

N-[[(2S)-4-(1-ethylcyclohexanecarbonyl)morpholin-2-yl]methyl]acetamide (PubChem CID 164629930) has the molecular formula C16H28N2O3 and a molecular weight of 296.41 g/mol. Its IUPAC name is N-[[(2S)-4-(1-ethylcyclohexanecarbonyl)morpholin-2-yl]methyl]acetamide.

Molecular Properties

Compound NameN-[[(2S)-4-(1-ethylcyclohexanecarbonyl)morpholin-2-yl]methyl]acetamide
PubChem CID164629930
Molecular FormulaC16H28N2O3
Molecular Weight296.41 g/mol
Exact Mass296.21
IUPAC NameN-[[(2S)-4-(1-ethylcyclohexanecarbonyl)morpholin-2-yl]methyl]acetamide
SMILESCCC1(C(=O)N2CCO[C@@H](CNC(C)=O)C2)CCCCC1
InChIInChI=1S/C16H28N2O3/c1-3-16(7-5-4-6-8-16)15(20)18-9-10-21-14(12-18)11-17-13(2)19/h14H,3-12H2,1-2H3,(H,17,19)/t14-/m0/s1
InChIKeyQIZJSRRVRZXHJG-AWEZNQCLSA-N
XLogP1.71
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.41
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[[(2S)-4-(1-ethylcyclohexanecarbonyl)morpholin-2-yl]methyl]acetamide?
The IUPAC name of N-[[(2S)-4-(1-ethylcyclohexanecarbonyl)morpholin-2-yl]methyl]acetamide (CID 164629930) is N-[[(2S)-4-(1-ethylcyclohexanecarbonyl)morpholin-2-yl]methyl]acetamide.
What is the SMILES notation for N-[[(2S)-4-(1-ethylcyclohexanecarbonyl)morpholin-2-yl]methyl]acetamide?
The canonical SMILES for N-[[(2S)-4-(1-ethylcyclohexanecarbonyl)morpholin-2-yl]methyl]acetamide is CCC1(C(=O)N2CCO[C@@H](CNC(C)=O)C2)CCCCC1.
What is the InChIKey of N-[[(2S)-4-(1-ethylcyclohexanecarbonyl)morpholin-2-yl]methyl]acetamide?
The InChIKey is QIZJSRRVRZXHJG-AWEZNQCLSA-N. The full InChI is InChI=1S/C16H28N2O3/c1-3-16(7-5-4-6-8-16)15(20)18-9-10-21-14(12-18)11-17-13(2)19/h14H,3-12H2,1-2H3,(H,17,19)/t14-/m0/s1.
What are the key properties of N-[[(2S)-4-(1-ethylcyclohexanecarbonyl)morpholin-2-yl]methyl]acetamide?
N-[[(2S)-4-(1-ethylcyclohexanecarbonyl)morpholin-2-yl]methyl]acetamide has a molecular weight of 296.41 g/mol, XLogP of 1.71, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(2S)-4-(1-ethylcyclohexanecarbonyl)morpholin-2-yl]methyl]acetamide is sourced from PubChem (CID 164629930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).