1-[cyclopentyl(morpholin-4-yl)methyl]cyclohexane-1-carboxamide

C17H30N2O2 — CID 67404335

IUPAC1-[cyclopentyl(morpholin-4-yl)methyl]cyclohexane-1-carboxamide
SMILESNC(=O)C1(C(C2CCCC2)N2CCOCC2)CCCCC1
InChIInChI=1S/C17H30N2O2/c18-16(20)17(8-4-1-5-9-17)15(14-6-2-3-7-14)19-10-12-21-13-11-19/h14-15H,1-13H2,(H2,18,20)
InChIKeyWWBWZUJWOSXKRV-UHFFFAOYSA-N
MW294.44 g/mol
LogP2.31
Rot. Bonds4

About 1-[cyclopentyl(morpholin-4-yl)methyl]cyclohexane-1-carboxamide

1-[cyclopentyl(morpholin-4-yl)methyl]cyclohexane-1-carboxamide (PubChem CID 67404335) has the molecular formula C17H30N2O2 and a molecular weight of 294.44 g/mol. Its IUPAC name is 1-[cyclopentyl(morpholin-4-yl)methyl]cyclohexane-1-carboxamide.

Molecular Properties

Compound Name1-[cyclopentyl(morpholin-4-yl)methyl]cyclohexane-1-carboxamide
PubChem CID67404335
Molecular FormulaC17H30N2O2
Molecular Weight294.44 g/mol
Exact Mass294.23
IUPAC Name1-[cyclopentyl(morpholin-4-yl)methyl]cyclohexane-1-carboxamide
SMILESNC(=O)C1(C(C2CCCC2)N2CCOCC2)CCCCC1
InChIInChI=1S/C17H30N2O2/c18-16(20)17(8-4-1-5-9-17)15(14-6-2-3-7-14)19-10-12-21-13-11-19/h14-15H,1-13H2,(H2,18,20)
InChIKeyWWBWZUJWOSXKRV-UHFFFAOYSA-N
XLogP2.31
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
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 1-[cyclopentyl(morpholin-4-yl)methyl]cyclohexane-1-carboxamide?
The IUPAC name of 1-[cyclopentyl(morpholin-4-yl)methyl]cyclohexane-1-carboxamide (CID 67404335) is 1-[cyclopentyl(morpholin-4-yl)methyl]cyclohexane-1-carboxamide.
What is the SMILES notation for 1-[cyclopentyl(morpholin-4-yl)methyl]cyclohexane-1-carboxamide?
The canonical SMILES for 1-[cyclopentyl(morpholin-4-yl)methyl]cyclohexane-1-carboxamide is NC(=O)C1(C(C2CCCC2)N2CCOCC2)CCCCC1.
What is the InChIKey of 1-[cyclopentyl(morpholin-4-yl)methyl]cyclohexane-1-carboxamide?
The InChIKey is WWBWZUJWOSXKRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N2O2/c18-16(20)17(8-4-1-5-9-17)15(14-6-2-3-7-14)19-10-12-21-13-11-19/h14-15H,1-13H2,(H2,18,20).
What are the key properties of 1-[cyclopentyl(morpholin-4-yl)methyl]cyclohexane-1-carboxamide?
1-[cyclopentyl(morpholin-4-yl)methyl]cyclohexane-1-carboxamide has a molecular weight of 294.44 g/mol, XLogP of 2.31, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[cyclopentyl(morpholin-4-yl)methyl]cyclohexane-1-carboxamide is sourced from PubChem (CID 67404335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).