(2R,3R,4R,5R)-N,N-dicyclohexyl-2,3,4,5,6-pentahydroxyhexanamide

C18H33NO6 — CID 98565543

IUPAC(2R,3R,4R,5R)-N,N-dicyclohexyl-2,3,4,5,6-pentahydroxyhexanamide
SMILESO=C([C@H](O)[C@H](O)[C@H](O)[C@H](O)CO)N(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C18H33NO6/c20-11-14(21)15(22)16(23)17(24)18(25)19(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h12-17,20-24H,1-11H2/t14-,15-,16-,17-/m1/s1
InChIKeyPSXGIKUTSBJBOU-QBPKDAKJSA-N
MW359.46 g/mol
LogP-0.08
Rot. Bonds7

About (2R,3R,4R,5R)-N,N-dicyclohexyl-2,3,4,5,6-pentahydroxyhexanamide

(2R,3R,4R,5R)-N,N-dicyclohexyl-2,3,4,5,6-pentahydroxyhexanamide (PubChem CID 98565543) has the molecular formula C18H33NO6 and a molecular weight of 359.46 g/mol. Its IUPAC name is (2R,3R,4R,5R)-N,N-dicyclohexyl-2,3,4,5,6-pentahydroxyhexanamide.

Molecular Properties

Compound Name(2R,3R,4R,5R)-N,N-dicyclohexyl-2,3,4,5,6-pentahydroxyhexanamide
PubChem CID98565543
Molecular FormulaC18H33NO6
Molecular Weight359.46 g/mol
Exact Mass359.23
IUPAC Name(2R,3R,4R,5R)-N,N-dicyclohexyl-2,3,4,5,6-pentahydroxyhexanamide
SMILESO=C([C@H](O)[C@H](O)[C@H](O)[C@H](O)CO)N(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C18H33NO6/c20-11-14(21)15(22)16(23)17(24)18(25)19(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h12-17,20-24H,1-11H2/t14-,15-,16-,17-/m1/s1
InChIKeyPSXGIKUTSBJBOU-QBPKDAKJSA-N
XLogP-0.08
TPSA121.46 Ų
H-Bond Donors5
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.46
LogP ≤ 5-0.08
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 106

Analyze (2R,3R,4R,5R)-N,N-dicyclohexyl-2,3,4,5,6-pentahydroxyhexanamide with MolForge

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Related Compounds

(2R,3S,4R,5R)-N-cyclohexyl-2,3,4,5,6-pentahydroxyhexanamide
CID 11482797
(2R,3R)-N',N'-dicyclohexyl-2,3-dihydroxybutanediamide
CID 91261250
(3S,4R,5S,6S)-3,4,5,6,7-pentahydroxyheptan-2-one
CID 122415477
3,4,5,6,7-pentahydroxyheptan-2-one;hydrate
CID 174796405
3,4,5,6,7,8-hexahydroxyoctan-2-one
CID 88547731
(2R,3S,4R,5R)-N-carbamoyl-2,3,4,5,6-pentahydroxy-N-methylhexanamide
CID 174309225
hexane-1,2,3,4,5,6-hexol;2,3,4,5,6-pentahydroxyhexanoic acid
CID 174726112
(4R)-2,3,4,5,6-pentahydroxyhexanoic acid
CID 134944021
(3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoic acid
CID 11479470
2-cyclohexyl-N-methyl-N-(2,3,4,5,6-pentahydroxyhexyl)acetamide
CID 20608406
N,N-dicyclohexyl-3,3,3-trifluoro-2-(trifluoromethyl)propanamide
CID 71672505
actinium;2,3,4,5,6-pentahydroxyhexanoic acid
CID 22966554

Frequently Asked Questions

What is the IUPAC name of (2R,3R,4R,5R)-N,N-dicyclohexyl-2,3,4,5,6-pentahydroxyhexanamide?
The IUPAC name of (2R,3R,4R,5R)-N,N-dicyclohexyl-2,3,4,5,6-pentahydroxyhexanamide (CID 98565543) is (2R,3R,4R,5R)-N,N-dicyclohexyl-2,3,4,5,6-pentahydroxyhexanamide.
What is the SMILES notation for (2R,3R,4R,5R)-N,N-dicyclohexyl-2,3,4,5,6-pentahydroxyhexanamide?
The canonical SMILES for (2R,3R,4R,5R)-N,N-dicyclohexyl-2,3,4,5,6-pentahydroxyhexanamide is O=C([C@H](O)[C@H](O)[C@H](O)[C@H](O)CO)N(C1CCCCC1)C1CCCCC1.
What is the InChIKey of (2R,3R,4R,5R)-N,N-dicyclohexyl-2,3,4,5,6-pentahydroxyhexanamide?
The InChIKey is PSXGIKUTSBJBOU-QBPKDAKJSA-N. The full InChI is InChI=1S/C18H33NO6/c20-11-14(21)15(22)16(23)17(24)18(25)19(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h12-17,20-24H,1-11H2/t14-,15-,16-,17-/m1/s1.
What are the key properties of (2R,3R,4R,5R)-N,N-dicyclohexyl-2,3,4,5,6-pentahydroxyhexanamide?
(2R,3R,4R,5R)-N,N-dicyclohexyl-2,3,4,5,6-pentahydroxyhexanamide has a molecular weight of 359.46 g/mol, XLogP of -0.08, 7 rotatable bonds, 5 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R,4R,5R)-N,N-dicyclohexyl-2,3,4,5,6-pentahydroxyhexanamide is sourced from PubChem (CID 98565543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).