1-[[(2R,6S)-2,6-dimethylmorpholine-4-carbonyl]amino]cyclohexane-1-carboxylic acid

C14H24N2O4 — CID 104959558

IUPAC1-[[(2R,6S)-2,6-dimethylmorpholine-4-carbonyl]amino]cyclohexane-1-carboxylic acid
SMILESC[C@@H]1CN(C(=O)NC2(C(=O)O)CCCCC2)C[C@H](C)O1
InChIInChI=1S/C14H24N2O4/c1-10-8-16(9-11(2)20-10)13(19)15-14(12(17)18)6-4-3-5-7-14/h10-11H,3-9H2,1-2H3,(H,15,19)(H,17,18)/t10-,11+
InChIKeyDRTVPALUGNEHPM-PHIMTYICSA-N
MW284.36 g/mol
LogP1.59
Rot. Bonds2

About 1-[[(2R,6S)-2,6-dimethylmorpholine-4-carbonyl]amino]cyclohexane-1-carboxylic acid

1-[[(2R,6S)-2,6-dimethylmorpholine-4-carbonyl]amino]cyclohexane-1-carboxylic acid (PubChem CID 104959558) has the molecular formula C14H24N2O4 and a molecular weight of 284.36 g/mol. Its IUPAC name is 1-[[(2R,6S)-2,6-dimethylmorpholine-4-carbonyl]amino]cyclohexane-1-carboxylic acid.

Molecular Properties

Compound Name1-[[(2R,6S)-2,6-dimethylmorpholine-4-carbonyl]amino]cyclohexane-1-carboxylic acid
PubChem CID104959558
Molecular FormulaC14H24N2O4
Molecular Weight284.36 g/mol
Exact Mass284.17
IUPAC Name1-[[(2R,6S)-2,6-dimethylmorpholine-4-carbonyl]amino]cyclohexane-1-carboxylic acid
SMILESC[C@@H]1CN(C(=O)NC2(C(=O)O)CCCCC2)C[C@H](C)O1
InChIInChI=1S/C14H24N2O4/c1-10-8-16(9-11(2)20-10)13(19)15-14(12(17)18)6-4-3-5-7-14/h10-11H,3-9H2,1-2H3,(H,15,19)(H,17,18)/t10-,11+
InChIKeyDRTVPALUGNEHPM-PHIMTYICSA-N
XLogP1.59
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-[[(2R,6S)-2,6-dimethylmorpholine-4-carbonyl]amino]cyclohexane-1-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[(2,6-dimethylmorpholine-4-carbonyl)amino]-3-methylcyclohexane-1-carboxylic acid
CID 61290338
1-[(3,5-dimethylpiperidine-1-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 61190558
1-[(3-methylpyrrolidine-1-carbonyl)amino]cycloheptane-1-carboxylic acid
CID 61225245
2-[1-[(2,6-dimethylmorpholine-4-carbonyl)amino]cyclopentyl]acetic acid
CID 64700428
1-[(2,5-dimethylmorpholine-4-carbonyl)amino]cycloheptane-1-carboxylic acid
CID 61202041
1-[(4-ethyl-3-methylpiperazine-1-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 63615527
1-[(4-methoxypiperidine-1-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 11608918
1-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]cycloheptane-1-carboxylic acid
CID 43437351
1-[[3-(methylaminomethyl)piperidine-1-carbonyl]amino]cyclohexane-1-carboxylic acid
CID 61408559
(2R,6R)-N-(1-adamantyl)-2,6-dimethylmorpholine-4-carboxamide
CID 7309747
1-[(4-aminopiperidine-1-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 61403018
1-[(3-methylmorpholine-4-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 61209789

Frequently Asked Questions

What is the IUPAC name of 1-[[(2R,6S)-2,6-dimethylmorpholine-4-carbonyl]amino]cyclohexane-1-carboxylic acid?
The IUPAC name of 1-[[(2R,6S)-2,6-dimethylmorpholine-4-carbonyl]amino]cyclohexane-1-carboxylic acid (CID 104959558) is 1-[[(2R,6S)-2,6-dimethylmorpholine-4-carbonyl]amino]cyclohexane-1-carboxylic acid.
What is the SMILES notation for 1-[[(2R,6S)-2,6-dimethylmorpholine-4-carbonyl]amino]cyclohexane-1-carboxylic acid?
The canonical SMILES for 1-[[(2R,6S)-2,6-dimethylmorpholine-4-carbonyl]amino]cyclohexane-1-carboxylic acid is C[C@@H]1CN(C(=O)NC2(C(=O)O)CCCCC2)C[C@H](C)O1.
What is the InChIKey of 1-[[(2R,6S)-2,6-dimethylmorpholine-4-carbonyl]amino]cyclohexane-1-carboxylic acid?
The InChIKey is DRTVPALUGNEHPM-PHIMTYICSA-N. The full InChI is InChI=1S/C14H24N2O4/c1-10-8-16(9-11(2)20-10)13(19)15-14(12(17)18)6-4-3-5-7-14/h10-11H,3-9H2,1-2H3,(H,15,19)(H,17,18)/t10-,11+.
What are the key properties of 1-[[(2R,6S)-2,6-dimethylmorpholine-4-carbonyl]amino]cyclohexane-1-carboxylic acid?
1-[[(2R,6S)-2,6-dimethylmorpholine-4-carbonyl]amino]cyclohexane-1-carboxylic acid has a molecular weight of 284.36 g/mol, XLogP of 1.59, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[(2R,6S)-2,6-dimethylmorpholine-4-carbonyl]amino]cyclohexane-1-carboxylic acid is sourced from PubChem (CID 104959558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).