(2S)-N-[(1R,2R)-2-methoxycyclohexyl]-2-(5-methylfuran-2-yl)morpholine-4-carboxamide

C17H26N2O4 — CID 98874217

IUPAC(2S)-N-[(1R,2R)-2-methoxycyclohexyl]-2-(5-methylfuran-2-yl)morpholine-4-carboxamide
SMILESCO[C@@H]1CCCC[C@H]1NC(=O)N1CCO[C@H](c2ccc(C)o2)C1
InChIInChI=1S/C17H26N2O4/c1-12-7-8-15(23-12)16-11-19(9-10-22-16)17(20)18-13-5-3-4-6-14(13)21-2/h7-8,13-14,16H,3-6,9-11H2,1-2H3,(H,18,20)/t13-,14-,16+/m1/s1
InChIKeyYGTGNUDSKJTOEB-FMKPAKJESA-N
MW322.40 g/mol
LogP2.63
Rot. Bonds3

About (2S)-N-[(1R,2R)-2-methoxycyclohexyl]-2-(5-methylfuran-2-yl)morpholine-4-carboxamide

(2S)-N-[(1R,2R)-2-methoxycyclohexyl]-2-(5-methylfuran-2-yl)morpholine-4-carboxamide (PubChem CID 98874217) has the molecular formula C17H26N2O4 and a molecular weight of 322.40 g/mol. Its IUPAC name is (2S)-N-[(1R,2R)-2-methoxycyclohexyl]-2-(5-methylfuran-2-yl)morpholine-4-carboxamide.

Molecular Properties

Compound Name(2S)-N-[(1R,2R)-2-methoxycyclohexyl]-2-(5-methylfuran-2-yl)morpholine-4-carboxamide
PubChem CID98874217
Molecular FormulaC17H26N2O4
Molecular Weight322.40 g/mol
Exact Mass322.19
IUPAC Name(2S)-N-[(1R,2R)-2-methoxycyclohexyl]-2-(5-methylfuran-2-yl)morpholine-4-carboxamide
SMILESCO[C@@H]1CCCC[C@H]1NC(=O)N1CCO[C@H](c2ccc(C)o2)C1
InChIInChI=1S/C17H26N2O4/c1-12-7-8-15(23-12)16-11-19(9-10-22-16)17(20)18-13-5-3-4-6-14(13)21-2/h7-8,13-14,16H,3-6,9-11H2,1-2H3,(H,18,20)/t13-,14-,16+/m1/s1
InChIKeyYGTGNUDSKJTOEB-FMKPAKJESA-N
XLogP2.63
TPSA63.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.40
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (2S)-N-[(1R,2R)-2-methoxycyclohexyl]-2-(5-methylfuran-2-yl)morpholine-4-carboxamide with MolForge

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Related Compounds

2-(5-methylfuran-2-yl)-N-(thian-3-yl)morpholine-4-carboxamide
CID 75389185
4-[(2-methoxycyclopentyl)carbamoyl]morpholine-2-carboxylic acid
CID 62088277
(2S)-N-[(1R)-4-hydroxy-2,3-dihydro-1H-inden-1-yl]-2-(5-methylfuran-2-yl)morpholine-4-carboxamide
CID 97242801
(2R)-N-(2-methoxy-3-pyridinyl)-2-(5-methylfuran-2-yl)morpholine-4-carboxamide
CID 124603422
3-hydroxy-N-(2-methoxycyclohexyl)piperidine-1-carboxamide
CID 111508397
N-[2-(dimethylamino)-6-methyl-3-pyridinyl]-2-(5-methylfuran-2-yl)morpholine-4-carboxamide
CID 75389140
N-[2-(2-hydroxyethyl)-4-methylpentyl]-2-(5-methylfuran-2-yl)morpholine-4-carboxamide
CID 109398792
(3R)-N-[(1R,2R)-2-methoxycyclohexyl]-3-(methoxymethyl)piperidine-1-carboxamide
CID 124741783
N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-2-(5-methylfuran-2-yl)morpholine-4-carboxamide
CID 75432430
(2R)-2-(5-methylfuran-2-yl)-N-[3-[(R)-methylsulfinyl]phenyl]morpholine-4-carboxamide
CID 97242640
1-[[(1R,2R)-2-methoxycyclopentyl]carbamoyl]pyrrolidine-3-carboxylic acid
CID 122016523
N-cyclopentyl-2-(4-methylphenyl)morpholine-4-carboxamide
CID 121134941

Frequently Asked Questions

What is the IUPAC name of (2S)-N-[(1R,2R)-2-methoxycyclohexyl]-2-(5-methylfuran-2-yl)morpholine-4-carboxamide?
The IUPAC name of (2S)-N-[(1R,2R)-2-methoxycyclohexyl]-2-(5-methylfuran-2-yl)morpholine-4-carboxamide (CID 98874217) is (2S)-N-[(1R,2R)-2-methoxycyclohexyl]-2-(5-methylfuran-2-yl)morpholine-4-carboxamide.
What is the SMILES notation for (2S)-N-[(1R,2R)-2-methoxycyclohexyl]-2-(5-methylfuran-2-yl)morpholine-4-carboxamide?
The canonical SMILES for (2S)-N-[(1R,2R)-2-methoxycyclohexyl]-2-(5-methylfuran-2-yl)morpholine-4-carboxamide is CO[C@@H]1CCCC[C@H]1NC(=O)N1CCO[C@H](c2ccc(C)o2)C1.
What is the InChIKey of (2S)-N-[(1R,2R)-2-methoxycyclohexyl]-2-(5-methylfuran-2-yl)morpholine-4-carboxamide?
The InChIKey is YGTGNUDSKJTOEB-FMKPAKJESA-N. The full InChI is InChI=1S/C17H26N2O4/c1-12-7-8-15(23-12)16-11-19(9-10-22-16)17(20)18-13-5-3-4-6-14(13)21-2/h7-8,13-14,16H,3-6,9-11H2,1-2H3,(H,18,20)/t13-,14-,16+/m1/s1.
What are the key properties of (2S)-N-[(1R,2R)-2-methoxycyclohexyl]-2-(5-methylfuran-2-yl)morpholine-4-carboxamide?
(2S)-N-[(1R,2R)-2-methoxycyclohexyl]-2-(5-methylfuran-2-yl)morpholine-4-carboxamide has a molecular weight of 322.40 g/mol, XLogP of 2.63, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-[(1R,2R)-2-methoxycyclohexyl]-2-(5-methylfuran-2-yl)morpholine-4-carboxamide is sourced from PubChem (CID 98874217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).