(2R,3R)-2,3-dihydroxy-N,N'-di(propan-2-yl)butanediamide

C10H20N2O4 — CID 10177016

IUPAC(2R,3R)-2,3-dihydroxy-N,N'-di(propan-2-yl)butanediamide
SMILESCC(C)NC(=O)[C@H](O)[C@@H](O)C(=O)NC(C)C
InChIInChI=1S/C10H20N2O4/c1-5(2)11-9(15)7(13)8(14)10(16)12-6(3)4/h5-8,13-14H,1-4H3,(H,11,15)(H,12,16)/t7-,8-/m1/s1
InChIKeyVEOCNEDNHXVTFZ-HTQZYQBOSA-N
MW232.28 g/mol
LogP-1.24
Rot. Bonds5

About (2R,3R)-2,3-dihydroxy-N,N'-di(propan-2-yl)butanediamide

(2R,3R)-2,3-dihydroxy-N,N'-di(propan-2-yl)butanediamide (PubChem CID 10177016) has the molecular formula C10H20N2O4 and a molecular weight of 232.28 g/mol. Its IUPAC name is (2R,3R)-2,3-dihydroxy-N,N'-di(propan-2-yl)butanediamide.

Molecular Properties

Compound Name(2R,3R)-2,3-dihydroxy-N,N'-di(propan-2-yl)butanediamide
PubChem CID10177016
Molecular FormulaC10H20N2O4
Molecular Weight232.28 g/mol
Exact Mass232.14
IUPAC Name(2R,3R)-2,3-dihydroxy-N,N'-di(propan-2-yl)butanediamide
SMILESCC(C)NC(=O)[C@H](O)[C@@H](O)C(=O)NC(C)C
InChIInChI=1S/C10H20N2O4/c1-5(2)11-9(15)7(13)8(14)10(16)12-6(3)4/h5-8,13-14H,1-4H3,(H,11,15)(H,12,16)/t7-,8-/m1/s1
InChIKeyVEOCNEDNHXVTFZ-HTQZYQBOSA-N
XLogP-1.24
TPSA98.66 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.28
LogP ≤ 5-1.24
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R,3R)-2,3-dihydroxy-N,N'-di(propan-2-yl)butanediamide?
The IUPAC name of (2R,3R)-2,3-dihydroxy-N,N'-di(propan-2-yl)butanediamide (CID 10177016) is (2R,3R)-2,3-dihydroxy-N,N'-di(propan-2-yl)butanediamide.
What is the SMILES notation for (2R,3R)-2,3-dihydroxy-N,N'-di(propan-2-yl)butanediamide?
The canonical SMILES for (2R,3R)-2,3-dihydroxy-N,N'-di(propan-2-yl)butanediamide is CC(C)NC(=O)[C@H](O)[C@@H](O)C(=O)NC(C)C.
What is the InChIKey of (2R,3R)-2,3-dihydroxy-N,N'-di(propan-2-yl)butanediamide?
The InChIKey is VEOCNEDNHXVTFZ-HTQZYQBOSA-N. The full InChI is InChI=1S/C10H20N2O4/c1-5(2)11-9(15)7(13)8(14)10(16)12-6(3)4/h5-8,13-14H,1-4H3,(H,11,15)(H,12,16)/t7-,8-/m1/s1.
What are the key properties of (2R,3R)-2,3-dihydroxy-N,N'-di(propan-2-yl)butanediamide?
(2R,3R)-2,3-dihydroxy-N,N'-di(propan-2-yl)butanediamide has a molecular weight of 232.28 g/mol, XLogP of -1.24, 5 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R)-2,3-dihydroxy-N,N'-di(propan-2-yl)butanediamide is sourced from PubChem (CID 10177016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).