N-(3,3,5,5-tetramethylcyclohexyl)morpholine-3-carboxamide

C15H28N2O2 — CID 103966646

IUPACN-(3,3,5,5-tetramethylcyclohexyl)morpholine-3-carboxamide
SMILESCC1(C)CC(NC(=O)C2COCCN2)CC(C)(C)C1
InChIInChI=1S/C15H28N2O2/c1-14(2)7-11(8-15(3,4)10-14)17-13(18)12-9-19-6-5-16-12/h11-12,16H,5-10H2,1-4H3,(H,17,18)
InChIKeyPDMBUXWNEJDAHH-UHFFFAOYSA-N
MW268.40 g/mol
LogP1.70
Rot. Bonds2

About N-(3,3,5,5-tetramethylcyclohexyl)morpholine-3-carboxamide

N-(3,3,5,5-tetramethylcyclohexyl)morpholine-3-carboxamide (PubChem CID 103966646) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is N-(3,3,5,5-tetramethylcyclohexyl)morpholine-3-carboxamide.

Molecular Properties

Compound NameN-(3,3,5,5-tetramethylcyclohexyl)morpholine-3-carboxamide
PubChem CID103966646
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC NameN-(3,3,5,5-tetramethylcyclohexyl)morpholine-3-carboxamide
SMILESCC1(C)CC(NC(=O)C2COCCN2)CC(C)(C)C1
InChIInChI=1S/C15H28N2O2/c1-14(2)7-11(8-15(3,4)10-14)17-13(18)12-9-19-6-5-16-12/h11-12,16H,5-10H2,1-4H3,(H,17,18)
InChIKeyPDMBUXWNEJDAHH-UHFFFAOYSA-N
XLogP1.70
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3,3,5,5-tetramethylcyclohexyl)morpholine-3-carboxamide?
The IUPAC name of N-(3,3,5,5-tetramethylcyclohexyl)morpholine-3-carboxamide (CID 103966646) is N-(3,3,5,5-tetramethylcyclohexyl)morpholine-3-carboxamide.
What is the SMILES notation for N-(3,3,5,5-tetramethylcyclohexyl)morpholine-3-carboxamide?
The canonical SMILES for N-(3,3,5,5-tetramethylcyclohexyl)morpholine-3-carboxamide is CC1(C)CC(NC(=O)C2COCCN2)CC(C)(C)C1.
What is the InChIKey of N-(3,3,5,5-tetramethylcyclohexyl)morpholine-3-carboxamide?
The InChIKey is PDMBUXWNEJDAHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-14(2)7-11(8-15(3,4)10-14)17-13(18)12-9-19-6-5-16-12/h11-12,16H,5-10H2,1-4H3,(H,17,18).
What are the key properties of N-(3,3,5,5-tetramethylcyclohexyl)morpholine-3-carboxamide?
N-(3,3,5,5-tetramethylcyclohexyl)morpholine-3-carboxamide has a molecular weight of 268.40 g/mol, XLogP of 1.70, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,3,5,5-tetramethylcyclohexyl)morpholine-3-carboxamide is sourced from PubChem (CID 103966646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).