propyl 2-[methyl(2-methylpropanoyl)amino]acetate

C10H19NO3 — CID 91692126

IUPACpropyl 2-[methyl(2-methylpropanoyl)amino]acetate
SMILESCCCOC(=O)CN(C)C(=O)C(C)C
InChIInChI=1S/C10H19NO3/c1-5-6-14-9(12)7-11(4)10(13)8(2)3/h8H,5-7H2,1-4H3
InChIKeyFILYKMUMZINGJC-UHFFFAOYSA-N
MW201.27 g/mol
LogP1.05
Rot. Bonds5

About propyl 2-[methyl(2-methylpropanoyl)amino]acetate

propyl 2-[methyl(2-methylpropanoyl)amino]acetate (PubChem CID 91692126) has the molecular formula C10H19NO3 and a molecular weight of 201.27 g/mol. Its IUPAC name is propyl 2-[methyl(2-methylpropanoyl)amino]acetate.

Molecular Properties

Compound Namepropyl 2-[methyl(2-methylpropanoyl)amino]acetate
PubChem CID91692126
Molecular FormulaC10H19NO3
Molecular Weight201.27 g/mol
Exact Mass201.14
IUPAC Namepropyl 2-[methyl(2-methylpropanoyl)amino]acetate
SMILESCCCOC(=O)CN(C)C(=O)C(C)C
InChIInChI=1S/C10H19NO3/c1-5-6-14-9(12)7-11(4)10(13)8(2)3/h8H,5-7H2,1-4H3
InChIKeyFILYKMUMZINGJC-UHFFFAOYSA-N
XLogP1.05
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 51.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

Glycine, N,N-diisobutyl-, ethyl ester
CID 17538
Glycine, N,N-diisopentyl-, ethyl ester
CID 17698
Ethyl 2-oxo-2-(n,n-dipropylamino)acetate
CID 300609
Ethyl 2-(2-methylpropanamido)acetate
CID 4674605
Methyl 2-[acetyl(methyl)amino]-3-methylbutanoate
CID 11019600
Sarcosine, n-pentafluoropropionyl-, isobutyl ester
CID 91730512
Sarcosine, N-isobutyryl-, ethyl ester
CID 61597567
ethyl 2-[3-(dimethylamino)-N-methylpropanamido]acetate hydrochloride
CID 155820219
Ethyl 2-[acetyl(methyl)amino]-3-methylbutanoate
CID 15446107
N-Acetyl-N-(2-butoxy-2-oxoethyl)glycine butyl ester
CID 90476080
3,3-Dimethyl-4-(3-methylbutanoyl)morpholin-2-one
CID 24316104
Sarcosine, N-cyclopropylcarbonyl-, ethyl ester
CID 54785103

Frequently Asked Questions

What is the IUPAC name of propyl 2-[methyl(2-methylpropanoyl)amino]acetate?
The IUPAC name of propyl 2-[methyl(2-methylpropanoyl)amino]acetate (CID 91692126) is propyl 2-[methyl(2-methylpropanoyl)amino]acetate.
What is the SMILES notation for propyl 2-[methyl(2-methylpropanoyl)amino]acetate?
The canonical SMILES for propyl 2-[methyl(2-methylpropanoyl)amino]acetate is CCCOC(=O)CN(C)C(=O)C(C)C.
What is the InChIKey of propyl 2-[methyl(2-methylpropanoyl)amino]acetate?
The InChIKey is FILYKMUMZINGJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO3/c1-5-6-14-9(12)7-11(4)10(13)8(2)3/h8H,5-7H2,1-4H3.
What are the key properties of propyl 2-[methyl(2-methylpropanoyl)amino]acetate?
propyl 2-[methyl(2-methylpropanoyl)amino]acetate has a molecular weight of 201.27 g/mol, XLogP of 1.05, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for propyl 2-[methyl(2-methylpropanoyl)amino]acetate is sourced from PubChem (CID 91692126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).