N-(2,3-dimethoxypropyl)-2-hydroxy-2-methylpropanamide

C9H19NO4 — CID 106509940

IUPACN-(2,3-dimethoxypropyl)-2-hydroxy-2-methylpropanamide
SMILESCOCC(CNC(=O)C(C)(C)O)OC
InChIInChI=1S/C9H19NO4/c1-9(2,12)8(11)10-5-7(14-4)6-13-3/h7,12H,5-6H2,1-4H3,(H,10,11)
InChIKeyXJZJWJIKDWNFDV-UHFFFAOYSA-N
MW205.25 g/mol
LogP-0.47
Rot. Bonds6

About N-(2,3-dimethoxypropyl)-2-hydroxy-2-methylpropanamide

N-(2,3-dimethoxypropyl)-2-hydroxy-2-methylpropanamide (PubChem CID 106509940) has the molecular formula C9H19NO4 and a molecular weight of 205.25 g/mol. Its IUPAC name is N-(2,3-dimethoxypropyl)-2-hydroxy-2-methylpropanamide.

Molecular Properties

Compound NameN-(2,3-dimethoxypropyl)-2-hydroxy-2-methylpropanamide
PubChem CID106509940
Molecular FormulaC9H19NO4
Molecular Weight205.25 g/mol
Exact Mass205.13
IUPAC NameN-(2,3-dimethoxypropyl)-2-hydroxy-2-methylpropanamide
SMILESCOCC(CNC(=O)C(C)(C)O)OC
InChIInChI=1S/C9H19NO4/c1-9(2,12)8(11)10-5-7(14-4)6-13-3/h7,12H,5-6H2,1-4H3,(H,10,11)
InChIKeyXJZJWJIKDWNFDV-UHFFFAOYSA-N
XLogP-0.47
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.25
LogP ≤ 5-0.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

tert-butyl N-[(2R)-2,3-dimethoxypropyl]carbamate
CID 87486747
2-(2,3-dimethoxypropylcarbamoyl)-3,3-dimethylbutanoic acid
CID 114101634
2-hydroxy-2-methyl-N-(3-methyl-2-propan-2-ylbutyl)propanamide
CID 103430628
3-amino-N-(2-hydroxy-3-methoxypropyl)-2,2-dimethylpropanamide
CID 115426751
4-amino-N-(2,3-dimethoxypropyl)cyclohexane-1-carboxamide
CID 114100069
2-hydroxy-N-(2-hydroxyethyl)-2-methylpropanamide
CID 21330073
2-hydroxy-N-(1-methoxypentan-2-yl)-2-methylpropanamide
CID 103430087
methyl 2-(2,3-dimethoxypropylamino)butanoate
CID 107302671
5-(2,3-dimethoxypropylcarbamoylamino)hexanoic acid
CID 114101270
2-(2,3-dimethoxypropylcarbamoylamino)pent-4-enoic acid
CID 114101302
2-hydroxy-2-methyl-N-[3-(2-methylpropoxy)propyl]propanamide
CID 104936506
4-(2,3-dimethoxypropylamino)-3-methylbenzoic acid
CID 114100439

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethoxypropyl)-2-hydroxy-2-methylpropanamide?
The IUPAC name of N-(2,3-dimethoxypropyl)-2-hydroxy-2-methylpropanamide (CID 106509940) is N-(2,3-dimethoxypropyl)-2-hydroxy-2-methylpropanamide.
What is the SMILES notation for N-(2,3-dimethoxypropyl)-2-hydroxy-2-methylpropanamide?
The canonical SMILES for N-(2,3-dimethoxypropyl)-2-hydroxy-2-methylpropanamide is COCC(CNC(=O)C(C)(C)O)OC.
What is the InChIKey of N-(2,3-dimethoxypropyl)-2-hydroxy-2-methylpropanamide?
The InChIKey is XJZJWJIKDWNFDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO4/c1-9(2,12)8(11)10-5-7(14-4)6-13-3/h7,12H,5-6H2,1-4H3,(H,10,11).
What are the key properties of N-(2,3-dimethoxypropyl)-2-hydroxy-2-methylpropanamide?
N-(2,3-dimethoxypropyl)-2-hydroxy-2-methylpropanamide has a molecular weight of 205.25 g/mol, XLogP of -0.47, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethoxypropyl)-2-hydroxy-2-methylpropanamide is sourced from PubChem (CID 106509940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).