N-[(1-morpholin-4-ylcyclohexyl)methyl]butanamide

C15H28N2O2 — CID 17010883

IUPACN-[(1-morpholin-4-ylcyclohexyl)methyl]butanamide
SMILESCCCC(=O)NCC1(N2CCOCC2)CCCCC1
InChIInChI=1S/C15H28N2O2/c1-2-6-14(18)16-13-15(7-4-3-5-8-15)17-9-11-19-12-10-17/h2-13H2,1H3,(H,16,18)
InChIKeyIARLFSSGABTZPC-UHFFFAOYSA-N
MW268.40 g/mol
LogP1.94
Rot. Bonds5

About N-[(1-morpholin-4-ylcyclohexyl)methyl]butanamide

N-[(1-morpholin-4-ylcyclohexyl)methyl]butanamide (PubChem CID 17010883) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is N-[(1-morpholin-4-ylcyclohexyl)methyl]butanamide.

Molecular Properties

Compound NameN-[(1-morpholin-4-ylcyclohexyl)methyl]butanamide
PubChem CID17010883
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC NameN-[(1-morpholin-4-ylcyclohexyl)methyl]butanamide
SMILESCCCC(=O)NCC1(N2CCOCC2)CCCCC1
InChIInChI=1S/C15H28N2O2/c1-2-6-14(18)16-13-15(7-4-3-5-8-15)17-9-11-19-12-10-17/h2-13H2,1H3,(H,16,18)
InChIKeyIARLFSSGABTZPC-UHFFFAOYSA-N
XLogP1.94
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(1-morpholin-4-ylcyclohexyl)methyl]butanamide?
The IUPAC name of N-[(1-morpholin-4-ylcyclohexyl)methyl]butanamide (CID 17010883) is N-[(1-morpholin-4-ylcyclohexyl)methyl]butanamide.
What is the SMILES notation for N-[(1-morpholin-4-ylcyclohexyl)methyl]butanamide?
The canonical SMILES for N-[(1-morpholin-4-ylcyclohexyl)methyl]butanamide is CCCC(=O)NCC1(N2CCOCC2)CCCCC1.
What is the InChIKey of N-[(1-morpholin-4-ylcyclohexyl)methyl]butanamide?
The InChIKey is IARLFSSGABTZPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-2-6-14(18)16-13-15(7-4-3-5-8-15)17-9-11-19-12-10-17/h2-13H2,1H3,(H,16,18).
What are the key properties of N-[(1-morpholin-4-ylcyclohexyl)methyl]butanamide?
N-[(1-morpholin-4-ylcyclohexyl)methyl]butanamide has a molecular weight of 268.40 g/mol, XLogP of 1.94, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-morpholin-4-ylcyclohexyl)methyl]butanamide is sourced from PubChem (CID 17010883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).