2-methyl-1-(1-morpholin-4-ylcyclopentyl)cyclohexane-1-carboxamide

C17H30N2O2 — CID 67404332

IUPAC2-methyl-1-(1-morpholin-4-ylcyclopentyl)cyclohexane-1-carboxamide
SMILESCC1CCCCC1(C(N)=O)C1(N2CCOCC2)CCCC1
InChIInChI=1S/C17H30N2O2/c1-14-6-2-3-9-17(14,15(18)20)16(7-4-5-8-16)19-10-12-21-13-11-19/h14H,2-13H2,1H3,(H2,18,20)
InChIKeySPJVJUWLYAEEED-UHFFFAOYSA-N
MW294.44 g/mol
LogP2.31
Rot. Bonds3

About 2-methyl-1-(1-morpholin-4-ylcyclopentyl)cyclohexane-1-carboxamide

2-methyl-1-(1-morpholin-4-ylcyclopentyl)cyclohexane-1-carboxamide (PubChem CID 67404332) has the molecular formula C17H30N2O2 and a molecular weight of 294.44 g/mol. Its IUPAC name is 2-methyl-1-(1-morpholin-4-ylcyclopentyl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name2-methyl-1-(1-morpholin-4-ylcyclopentyl)cyclohexane-1-carboxamide
PubChem CID67404332
Molecular FormulaC17H30N2O2
Molecular Weight294.44 g/mol
Exact Mass294.23
IUPAC Name2-methyl-1-(1-morpholin-4-ylcyclopentyl)cyclohexane-1-carboxamide
SMILESCC1CCCCC1(C(N)=O)C1(N2CCOCC2)CCCC1
InChIInChI=1S/C17H30N2O2/c1-14-6-2-3-9-17(14,15(18)20)16(7-4-5-8-16)19-10-12-21-13-11-19/h14H,2-13H2,1H3,(H2,18,20)
InChIKeySPJVJUWLYAEEED-UHFFFAOYSA-N
XLogP2.31
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.44
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(1-morpholin-4-ylcyclopentyl)cyclohexane-1-carboxamide?
The IUPAC name of 2-methyl-1-(1-morpholin-4-ylcyclopentyl)cyclohexane-1-carboxamide (CID 67404332) is 2-methyl-1-(1-morpholin-4-ylcyclopentyl)cyclohexane-1-carboxamide.
What is the SMILES notation for 2-methyl-1-(1-morpholin-4-ylcyclopentyl)cyclohexane-1-carboxamide?
The canonical SMILES for 2-methyl-1-(1-morpholin-4-ylcyclopentyl)cyclohexane-1-carboxamide is CC1CCCCC1(C(N)=O)C1(N2CCOCC2)CCCC1.
What is the InChIKey of 2-methyl-1-(1-morpholin-4-ylcyclopentyl)cyclohexane-1-carboxamide?
The InChIKey is SPJVJUWLYAEEED-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N2O2/c1-14-6-2-3-9-17(14,15(18)20)16(7-4-5-8-16)19-10-12-21-13-11-19/h14H,2-13H2,1H3,(H2,18,20).
What are the key properties of 2-methyl-1-(1-morpholin-4-ylcyclopentyl)cyclohexane-1-carboxamide?
2-methyl-1-(1-morpholin-4-ylcyclopentyl)cyclohexane-1-carboxamide has a molecular weight of 294.44 g/mol, XLogP of 2.31, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(1-morpholin-4-ylcyclopentyl)cyclohexane-1-carboxamide is sourced from PubChem (CID 67404332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).