2-(2,3-dihydroxypropylamino)-N-(2-methylbutan-2-yl)acetamide

C10H22N2O3 — CID 66168467

IUPAC2-(2,3-dihydroxypropylamino)-N-(2-methylbutan-2-yl)acetamide
SMILESCCC(C)(C)NC(=O)CNCC(O)CO
InChIInChI=1S/C10H22N2O3/c1-4-10(2,3)12-9(15)6-11-5-8(14)7-13/h8,11,13-14H,4-7H2,1-3H3,(H,12,15)
InChIKeyJDMRXESSMBEVKQ-UHFFFAOYSA-N
MW218.30 g/mol
LogP-0.77
Rot. Bonds7

About 2-(2,3-dihydroxypropylamino)-N-(2-methylbutan-2-yl)acetamide

2-(2,3-dihydroxypropylamino)-N-(2-methylbutan-2-yl)acetamide (PubChem CID 66168467) has the molecular formula C10H22N2O3 and a molecular weight of 218.30 g/mol. Its IUPAC name is 2-(2,3-dihydroxypropylamino)-N-(2-methylbutan-2-yl)acetamide.

Molecular Properties

Compound Name2-(2,3-dihydroxypropylamino)-N-(2-methylbutan-2-yl)acetamide
PubChem CID66168467
Molecular FormulaC10H22N2O3
Molecular Weight218.30 g/mol
Exact Mass218.16
IUPAC Name2-(2,3-dihydroxypropylamino)-N-(2-methylbutan-2-yl)acetamide
SMILESCCC(C)(C)NC(=O)CNCC(O)CO
InChIInChI=1S/C10H22N2O3/c1-4-10(2,3)12-9(15)6-11-5-8(14)7-13/h8,11,13-14H,4-7H2,1-3H3,(H,12,15)
InChIKeyJDMRXESSMBEVKQ-UHFFFAOYSA-N
XLogP-0.77
TPSA81.59 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 5-0.77
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-hydroxyethylamino)-N-(2-methylbutan-2-yl)acetamide
CID 60671300
N-tert-butyl-2-(2-hydroxybutylamino)acetamide
CID 115356599
2-[[(2S)-2,3-dihydroxypropyl]amino]-N-propan-2-ylacetamide
CID 61142666
3-hydroxy-N-(2-methylbutan-2-yl)butanamide
CID 87908743
2-hydroxy-N-(2-methylbutan-2-yl)acetamide
CID 43558880
2-(2,3-dihydroxypropylamino)-N-(3-methylbutan-2-yl)acetamide
CID 66171224
2-[(5-hydroxy-2,2-dimethylpentyl)amino]-N-(2-methylbutan-2-yl)acetamide
CID 106147113
N-(2-methylbutan-2-yl)-2-[(1-propan-2-ylcyclopropyl)methylamino]acetamide
CID 114113627
2-(cyclopentylmethylamino)-N-(2-methylbutan-2-yl)acetamide
CID 61486055
2-(2,2-dimethylhydrazinyl)-N-(2-methylbutan-2-yl)acetamide
CID 83015090
2-(2,3-dihydroxypropylamino)-N,N-dimethylacetamide
CID 60901605
2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-N-(2-methylbutan-2-yl)acetamide
CID 60672282

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydroxypropylamino)-N-(2-methylbutan-2-yl)acetamide?
The IUPAC name of 2-(2,3-dihydroxypropylamino)-N-(2-methylbutan-2-yl)acetamide (CID 66168467) is 2-(2,3-dihydroxypropylamino)-N-(2-methylbutan-2-yl)acetamide.
What is the SMILES notation for 2-(2,3-dihydroxypropylamino)-N-(2-methylbutan-2-yl)acetamide?
The canonical SMILES for 2-(2,3-dihydroxypropylamino)-N-(2-methylbutan-2-yl)acetamide is CCC(C)(C)NC(=O)CNCC(O)CO.
What is the InChIKey of 2-(2,3-dihydroxypropylamino)-N-(2-methylbutan-2-yl)acetamide?
The InChIKey is JDMRXESSMBEVKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O3/c1-4-10(2,3)12-9(15)6-11-5-8(14)7-13/h8,11,13-14H,4-7H2,1-3H3,(H,12,15).
What are the key properties of 2-(2,3-dihydroxypropylamino)-N-(2-methylbutan-2-yl)acetamide?
2-(2,3-dihydroxypropylamino)-N-(2-methylbutan-2-yl)acetamide has a molecular weight of 218.30 g/mol, XLogP of -0.77, 7 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydroxypropylamino)-N-(2-methylbutan-2-yl)acetamide is sourced from PubChem (CID 66168467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).