2-morpholin-4-yl-N-(1,3,3,5-tetramethylcyclohexyl)acetamide;hydrochloride

C16H31ClN2O2 — CID 3066034

IUPAC2-morpholin-4-yl-N-(1,3,3,5-tetramethylcyclohexyl)acetamide;hydrochloride
SMILESCC1CC(C)(C)CC(C)(NC(=O)CN2CCOCC2)C1.Cl
InChIInChI=1S/C16H30N2O2.ClH/c1-13-9-15(2,3)12-16(4,10-13)17-14(19)11-18-5-7-20-8-6-18;/h13H,5-12H2,1-4H3,(H,17,19);1H
InChIKeyPXVANOWCPYSZHN-UHFFFAOYSA-N
MW318.89 g/mol
LogP2.46
Rot. Bonds3

About 2-morpholin-4-yl-N-(1,3,3,5-tetramethylcyclohexyl)acetamide;hydrochloride

2-morpholin-4-yl-N-(1,3,3,5-tetramethylcyclohexyl)acetamide;hydrochloride (PubChem CID 3066034) has the molecular formula C16H31ClN2O2 and a molecular weight of 318.89 g/mol. Its IUPAC name is 2-morpholin-4-yl-N-(1,3,3,5-tetramethylcyclohexyl)acetamide;hydrochloride.

Molecular Properties

Compound Name2-morpholin-4-yl-N-(1,3,3,5-tetramethylcyclohexyl)acetamide;hydrochloride
PubChem CID3066034
Molecular FormulaC16H31ClN2O2
Molecular Weight318.89 g/mol
Exact Mass318.21
IUPAC Name2-morpholin-4-yl-N-(1,3,3,5-tetramethylcyclohexyl)acetamide;hydrochloride
SMILESCC1CC(C)(C)CC(C)(NC(=O)CN2CCOCC2)C1.Cl
InChIInChI=1S/C16H30N2O2.ClH/c1-13-9-15(2,3)12-16(4,10-13)17-14(19)11-18-5-7-20-8-6-18;/h13H,5-12H2,1-4H3,(H,17,19);1H
InChIKeyPXVANOWCPYSZHN-UHFFFAOYSA-N
XLogP2.46
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.89
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-yl-N-(1,3,3,5-tetramethylcyclohexyl)acetamide;hydrochloride?
The IUPAC name of 2-morpholin-4-yl-N-(1,3,3,5-tetramethylcyclohexyl)acetamide;hydrochloride (CID 3066034) is 2-morpholin-4-yl-N-(1,3,3,5-tetramethylcyclohexyl)acetamide;hydrochloride.
What is the SMILES notation for 2-morpholin-4-yl-N-(1,3,3,5-tetramethylcyclohexyl)acetamide;hydrochloride?
The canonical SMILES for 2-morpholin-4-yl-N-(1,3,3,5-tetramethylcyclohexyl)acetamide;hydrochloride is CC1CC(C)(C)CC(C)(NC(=O)CN2CCOCC2)C1.Cl.
What is the InChIKey of 2-morpholin-4-yl-N-(1,3,3,5-tetramethylcyclohexyl)acetamide;hydrochloride?
The InChIKey is PXVANOWCPYSZHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O2.ClH/c1-13-9-15(2,3)12-16(4,10-13)17-14(19)11-18-5-7-20-8-6-18;/h13H,5-12H2,1-4H3,(H,17,19);1H.
What are the key properties of 2-morpholin-4-yl-N-(1,3,3,5-tetramethylcyclohexyl)acetamide;hydrochloride?
2-morpholin-4-yl-N-(1,3,3,5-tetramethylcyclohexyl)acetamide;hydrochloride has a molecular weight of 318.89 g/mol, XLogP of 2.46, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-yl-N-(1,3,3,5-tetramethylcyclohexyl)acetamide;hydrochloride is sourced from PubChem (CID 3066034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).