N-(cyclohexylmethyl)morpholine-4-carboxamide

C12H22N2O2 — CID 4626362

IUPACN-(cyclohexylmethyl)morpholine-4-carboxamide
SMILESO=C(NCC1CCCCC1)N1CCOCC1
InChIInChI=1S/C12H22N2O2/c15-12(14-6-8-16-9-7-14)13-10-11-4-2-1-3-5-11/h11H,1-10H2,(H,13,15)
InChIKeyBPXWOBUQKMMZKJ-UHFFFAOYSA-N
MW226.32 g/mol
LogP1.61
Rot. Bonds2

About N-(cyclohexylmethyl)morpholine-4-carboxamide

N-(cyclohexylmethyl)morpholine-4-carboxamide (PubChem CID 4626362) has the molecular formula C12H22N2O2 and a molecular weight of 226.32 g/mol. Its IUPAC name is N-(cyclohexylmethyl)morpholine-4-carboxamide.

Molecular Properties

Compound NameN-(cyclohexylmethyl)morpholine-4-carboxamide
PubChem CID4626362
Molecular FormulaC12H22N2O2
Molecular Weight226.32 g/mol
Exact Mass226.17
IUPAC NameN-(cyclohexylmethyl)morpholine-4-carboxamide
SMILESO=C(NCC1CCCCC1)N1CCOCC1
InChIInChI=1S/C12H22N2O2/c15-12(14-6-8-16-9-7-14)13-10-11-4-2-1-3-5-11/h11H,1-10H2,(H,13,15)
InChIKeyBPXWOBUQKMMZKJ-UHFFFAOYSA-N
XLogP1.61
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylmethyl)morpholine-4-carboxamide?
The IUPAC name of N-(cyclohexylmethyl)morpholine-4-carboxamide (CID 4626362) is N-(cyclohexylmethyl)morpholine-4-carboxamide.
What is the SMILES notation for N-(cyclohexylmethyl)morpholine-4-carboxamide?
The canonical SMILES for N-(cyclohexylmethyl)morpholine-4-carboxamide is O=C(NCC1CCCCC1)N1CCOCC1.
What is the InChIKey of N-(cyclohexylmethyl)morpholine-4-carboxamide?
The InChIKey is BPXWOBUQKMMZKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2/c15-12(14-6-8-16-9-7-14)13-10-11-4-2-1-3-5-11/h11H,1-10H2,(H,13,15).
What are the key properties of N-(cyclohexylmethyl)morpholine-4-carboxamide?
N-(cyclohexylmethyl)morpholine-4-carboxamide has a molecular weight of 226.32 g/mol, XLogP of 1.61, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylmethyl)morpholine-4-carboxamide is sourced from PubChem (CID 4626362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).