N-[1,3-dimethoxy-2-(methoxymethyl)propan-2-yl]acetamide

C9H19NO4 — CID 126717366

IUPACN-[1,3-dimethoxy-2-(methoxymethyl)propan-2-yl]acetamide
SMILESCOCC(COC)(COC)NC(C)=O
InChIInChI=1S/C9H19NO4/c1-8(11)10-9(5-12-2,6-13-3)7-14-4/h5-7H2,1-4H3,(H,10,11)
InChIKeyOAHGUIAWIFNVLH-UHFFFAOYSA-N
MW205.25 g/mol
LogP-0.20
Rot. Bonds7

About N-[1,3-dimethoxy-2-(methoxymethyl)propan-2-yl]acetamide

N-[1,3-dimethoxy-2-(methoxymethyl)propan-2-yl]acetamide (PubChem CID 126717366) has the molecular formula C9H19NO4 and a molecular weight of 205.25 g/mol. Its IUPAC name is N-[1,3-dimethoxy-2-(methoxymethyl)propan-2-yl]acetamide.

Molecular Properties

Compound NameN-[1,3-dimethoxy-2-(methoxymethyl)propan-2-yl]acetamide
PubChem CID126717366
Molecular FormulaC9H19NO4
Molecular Weight205.25 g/mol
Exact Mass205.13
IUPAC NameN-[1,3-dimethoxy-2-(methoxymethyl)propan-2-yl]acetamide
SMILESCOCC(COC)(COC)NC(C)=O
InChIInChI=1S/C9H19NO4/c1-8(11)10-9(5-12-2,6-13-3)7-14-4/h5-7H2,1-4H3,(H,10,11)
InChIKeyOAHGUIAWIFNVLH-UHFFFAOYSA-N
XLogP-0.20
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.25
LogP ≤ 5-0.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1,3-dimethoxy-2-(methoxymethyl)propan-2-yl]prop-2-enamide
CID 86215980
N-[1,3-bis[[tert-butyl(dimethyl)silyl]oxy]-2-[[tert-butyl(dimethyl)silyl]oxymethyl]propan-2-yl]acetamide
CID 91697077
3-[2-acetamido-3-[3-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethylamino]-3-oxopropoxy]-2-[[3-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethylamino]-3-oxopropoxy]methyl]propoxy]-N-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]propanamide
CID 171599700
acetamide;N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]acetamide
CID 159639150
5-methoxy-4,4-dimethylpentan-2-one
CID 54387019
(2S)-2-acetamido-3-acetyloxy-2-methylpropanoic acid
CID 102238422
1-(1-methoxy-2-methylpropan-2-yl)-3-methylurea
CID 115690659
methyl 2-acetamido-2-methyl-3-oxobutanoate
CID 87370623
methyl 2,2-difluoro-3-methoxypropanoate
CID 2769543
N-(2-cyano-4-methoxybutan-2-yl)acetamide
CID 166604136
methyl (2R)-2-amino-3-methoxy-2-methylpropanoate
CID 45086680
methyl 3-acetamido-2,2,3-trimethylbutanoate
CID 21299733

Frequently Asked Questions

What is the IUPAC name of N-[1,3-dimethoxy-2-(methoxymethyl)propan-2-yl]acetamide?
The IUPAC name of N-[1,3-dimethoxy-2-(methoxymethyl)propan-2-yl]acetamide (CID 126717366) is N-[1,3-dimethoxy-2-(methoxymethyl)propan-2-yl]acetamide.
What is the SMILES notation for N-[1,3-dimethoxy-2-(methoxymethyl)propan-2-yl]acetamide?
The canonical SMILES for N-[1,3-dimethoxy-2-(methoxymethyl)propan-2-yl]acetamide is COCC(COC)(COC)NC(C)=O.
What is the InChIKey of N-[1,3-dimethoxy-2-(methoxymethyl)propan-2-yl]acetamide?
The InChIKey is OAHGUIAWIFNVLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO4/c1-8(11)10-9(5-12-2,6-13-3)7-14-4/h5-7H2,1-4H3,(H,10,11).
What are the key properties of N-[1,3-dimethoxy-2-(methoxymethyl)propan-2-yl]acetamide?
N-[1,3-dimethoxy-2-(methoxymethyl)propan-2-yl]acetamide has a molecular weight of 205.25 g/mol, XLogP of -0.20, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1,3-dimethoxy-2-(methoxymethyl)propan-2-yl]acetamide is sourced from PubChem (CID 126717366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).