(2R,6R)-4-[[(1S,6S)-2,6-dimethylcyclohex-2-en-1-yl]methyl]-6-methylmorpholine-2-carboxamide

C15H26N2O2 — CID 129429790

IUPAC(2R,6R)-4-[[(1S,6S)-2,6-dimethylcyclohex-2-en-1-yl]methyl]-6-methylmorpholine-2-carboxamide
SMILESCC1=CCC[C@H](C)[C@@H]1CN1C[C@@H](C)O[C@@H](C(N)=O)C1
InChIInChI=1S/C15H26N2O2/c1-10-5-4-6-11(2)13(10)8-17-7-12(3)19-14(9-17)15(16)18/h5,11-14H,4,6-9H2,1-3H3,(H2,16,18)/t11-,12+,13+,14+/m0/s1
InChIKeyPMKCMSBMXOZEQH-REWJHTLYSA-N
MW266.38 g/mol
LogP1.55
Rot. Bonds3

About (2R,6R)-4-[[(1S,6S)-2,6-dimethylcyclohex-2-en-1-yl]methyl]-6-methylmorpholine-2-carboxamide

(2R,6R)-4-[[(1S,6S)-2,6-dimethylcyclohex-2-en-1-yl]methyl]-6-methylmorpholine-2-carboxamide (PubChem CID 129429790) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is (2R,6R)-4-[[(1S,6S)-2,6-dimethylcyclohex-2-en-1-yl]methyl]-6-methylmorpholine-2-carboxamide.

Molecular Properties

Compound Name(2R,6R)-4-[[(1S,6S)-2,6-dimethylcyclohex-2-en-1-yl]methyl]-6-methylmorpholine-2-carboxamide
PubChem CID129429790
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC Name(2R,6R)-4-[[(1S,6S)-2,6-dimethylcyclohex-2-en-1-yl]methyl]-6-methylmorpholine-2-carboxamide
SMILESCC1=CCC[C@H](C)[C@@H]1CN1C[C@@H](C)O[C@@H](C(N)=O)C1
InChIInChI=1S/C15H26N2O2/c1-10-5-4-6-11(2)13(10)8-17-7-12(3)19-14(9-17)15(16)18/h5,11-14H,4,6-9H2,1-3H3,(H2,16,18)/t11-,12+,13+,14+/m0/s1
InChIKeyPMKCMSBMXOZEQH-REWJHTLYSA-N
XLogP1.55
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(2R,6R)-4-[[(1R,6S)-2,6-dimethylcyclohex-2-en-1-yl]methyl]-6-methylmorpholine-2-carboxamide
CID 129429791
(2S)-4-[[(1R,6S)-2,6-dimethylcyclohex-2-en-1-yl]methyl]morpholine-2-carboxamide
CID 99790031
4-[[(1S,6R)-2,6-dimethylcyclohex-2-en-1-yl]methyl]-1,4-diazepane-1-carboxamide
CID 129401310
[1-[[(1S,6S)-2,6-dimethylcyclohex-2-en-1-yl]methyl]piperidin-4-yl]-morpholin-4-ylmethanone
CID 99857996
2-[(6R)-2-carbamoyl-6-methylmorpholin-4-yl]acetic acid;hydrochloride
CID 130735459
1-[[(1S,6S)-2,6-dimethylcyclohex-2-en-1-yl]methyl]-N-propan-2-ylpiperidine-4-carboxamide
CID 99858017
(8aR)-7-[[(1R,6S)-2,6-dimethylcyclohex-2-en-1-yl]methyl]-1,2,5,6,8,8a-hexahydroimidazo[1,5-a]pyrazin-3-one
CID 99832502
(2R,6R)-4-[(4-bromo-3-methylphenyl)methyl]-6-methylmorpholine-2-carboxamide
CID 124516000
(2S,6R)-4-[(2R)-2-(3-chlorophenyl)propyl]-6-methylmorpholine-2-carboxamide
CID 99857105
2,6-dimethylcyclohex-2-ene-1-carboxylic acid
CID 45084784
1-[[(1R,6R)-2,6-dimethylcyclohex-2-en-1-yl]methyl]-4-(1,2,4-triazol-1-yl)piperidine
CID 99832402
methyl (2S,6R)-4-(cyclobutylmethyl)-6-methylmorpholine-2-carboxylate
CID 97064897

Frequently Asked Questions

What is the IUPAC name of (2R,6R)-4-[[(1S,6S)-2,6-dimethylcyclohex-2-en-1-yl]methyl]-6-methylmorpholine-2-carboxamide?
The IUPAC name of (2R,6R)-4-[[(1S,6S)-2,6-dimethylcyclohex-2-en-1-yl]methyl]-6-methylmorpholine-2-carboxamide (CID 129429790) is (2R,6R)-4-[[(1S,6S)-2,6-dimethylcyclohex-2-en-1-yl]methyl]-6-methylmorpholine-2-carboxamide.
What is the SMILES notation for (2R,6R)-4-[[(1S,6S)-2,6-dimethylcyclohex-2-en-1-yl]methyl]-6-methylmorpholine-2-carboxamide?
The canonical SMILES for (2R,6R)-4-[[(1S,6S)-2,6-dimethylcyclohex-2-en-1-yl]methyl]-6-methylmorpholine-2-carboxamide is CC1=CCC[C@H](C)[C@@H]1CN1C[C@@H](C)O[C@@H](C(N)=O)C1.
What is the InChIKey of (2R,6R)-4-[[(1S,6S)-2,6-dimethylcyclohex-2-en-1-yl]methyl]-6-methylmorpholine-2-carboxamide?
The InChIKey is PMKCMSBMXOZEQH-REWJHTLYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-10-5-4-6-11(2)13(10)8-17-7-12(3)19-14(9-17)15(16)18/h5,11-14H,4,6-9H2,1-3H3,(H2,16,18)/t11-,12+,13+,14+/m0/s1.
What are the key properties of (2R,6R)-4-[[(1S,6S)-2,6-dimethylcyclohex-2-en-1-yl]methyl]-6-methylmorpholine-2-carboxamide?
(2R,6R)-4-[[(1S,6S)-2,6-dimethylcyclohex-2-en-1-yl]methyl]-6-methylmorpholine-2-carboxamide has a molecular weight of 266.38 g/mol, XLogP of 1.55, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,6R)-4-[[(1S,6S)-2,6-dimethylcyclohex-2-en-1-yl]methyl]-6-methylmorpholine-2-carboxamide is sourced from PubChem (CID 129429790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).