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

C18H32N2O2 — CID 67405338

IUPAC1-[cyclohexyl(morpholin-4-yl)methyl]cyclohexane-1-carboxamide
SMILESNC(=O)C1(C(C2CCCCC2)N2CCOCC2)CCCCC1
InChIInChI=1S/C18H32N2O2/c19-17(21)18(9-5-2-6-10-18)16(15-7-3-1-4-8-15)20-11-13-22-14-12-20/h15-16H,1-14H2,(H2,19,21)
InChIKeyAWMXKUTWSBVPGG-UHFFFAOYSA-N
MW308.47 g/mol
LogP2.70
Rot. Bonds4

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

1-[cyclohexyl(morpholin-4-yl)methyl]cyclohexane-1-carboxamide (PubChem CID 67405338) has the molecular formula C18H32N2O2 and a molecular weight of 308.47 g/mol. Its IUPAC name is 1-[cyclohexyl(morpholin-4-yl)methyl]cyclohexane-1-carboxamide.

Molecular Properties

Compound Name1-[cyclohexyl(morpholin-4-yl)methyl]cyclohexane-1-carboxamide
PubChem CID67405338
Molecular FormulaC18H32N2O2
Molecular Weight308.47 g/mol
Exact Mass308.25
IUPAC Name1-[cyclohexyl(morpholin-4-yl)methyl]cyclohexane-1-carboxamide
SMILESNC(=O)C1(C(C2CCCCC2)N2CCOCC2)CCCCC1
InChIInChI=1S/C18H32N2O2/c19-17(21)18(9-5-2-6-10-18)16(15-7-3-1-4-8-15)20-11-13-22-14-12-20/h15-16H,1-14H2,(H2,19,21)
InChIKeyAWMXKUTWSBVPGG-UHFFFAOYSA-N
XLogP2.70
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.47
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[cyclohexyl(morpholin-4-yl)methyl]cyclohexane-1-carboxamide?
The IUPAC name of 1-[cyclohexyl(morpholin-4-yl)methyl]cyclohexane-1-carboxamide (CID 67405338) is 1-[cyclohexyl(morpholin-4-yl)methyl]cyclohexane-1-carboxamide.
What is the SMILES notation for 1-[cyclohexyl(morpholin-4-yl)methyl]cyclohexane-1-carboxamide?
The canonical SMILES for 1-[cyclohexyl(morpholin-4-yl)methyl]cyclohexane-1-carboxamide is NC(=O)C1(C(C2CCCCC2)N2CCOCC2)CCCCC1.
What is the InChIKey of 1-[cyclohexyl(morpholin-4-yl)methyl]cyclohexane-1-carboxamide?
The InChIKey is AWMXKUTWSBVPGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H32N2O2/c19-17(21)18(9-5-2-6-10-18)16(15-7-3-1-4-8-15)20-11-13-22-14-12-20/h15-16H,1-14H2,(H2,19,21).
What are the key properties of 1-[cyclohexyl(morpholin-4-yl)methyl]cyclohexane-1-carboxamide?
1-[cyclohexyl(morpholin-4-yl)methyl]cyclohexane-1-carboxamide has a molecular weight of 308.47 g/mol, XLogP of 2.70, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[cyclohexyl(morpholin-4-yl)methyl]cyclohexane-1-carboxamide is sourced from PubChem (CID 67405338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).