methyl 2-[bis(2-methylpropyl)amino]acetate

C11H23NO2 — CID 18948397

IUPACmethyl 2-[bis(2-methylpropyl)amino]acetate
SMILESCOC(=O)CN(CC(C)C)CC(C)C
InChIInChI=1S/C11H23NO2/c1-9(2)6-12(7-10(3)4)8-11(13)14-5/h9-10H,6-8H2,1-5H3
InChIKeyUNXHBMFRNPYZKM-UHFFFAOYSA-N
MW201.31 g/mol
LogP1.77
Rot. Bonds6

About methyl 2-[bis(2-methylpropyl)amino]acetate

methyl 2-[bis(2-methylpropyl)amino]acetate (PubChem CID 18948397) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is methyl 2-[bis(2-methylpropyl)amino]acetate.

Molecular Properties

Compound Namemethyl 2-[bis(2-methylpropyl)amino]acetate
PubChem CID18948397
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC Namemethyl 2-[bis(2-methylpropyl)amino]acetate
SMILESCOC(=O)CN(CC(C)C)CC(C)C
InChIInChI=1S/C11H23NO2/c1-9(2)6-12(7-10(3)4)8-11(13)14-5/h9-10H,6-8H2,1-5H3
InChIKeyUNXHBMFRNPYZKM-UHFFFAOYSA-N
XLogP1.77
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 51.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze methyl 2-[bis(2-methylpropyl)amino]acetate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Glycine, N,N-diethyl-, ethyl ester
CID 75843
2-(Tripropylazaniumyl)acetate
CID 11481092
(Tributylazaniumyl)acetate
CID 24181864
Glycine, N,N-dibutyl-, ethyl ester
CID 17537
Glycine, N,N-diisobutyl-, ethyl ester
CID 17538
Methyl 2-[bis(2-methoxyethyl)amino]acetate
CID 47010756
Glycine, N,N-diisopentyl-, ethyl ester
CID 17698
2-(Butyldimethylazaniumyl)acetate
CID 59787792
Methyl 2-([2-(tert-butoxy)-2-oxoethyl](2-methoxy-2-oxoethyl)amino)acetate
CID 62954172
Trimethyl 2,2',2''-nitrilotriacetate
CID 14440960
Ethyl 2-(dipropylamino)acetate
CID 575237
Methyl 2-[2-fluoropropyl(methyl)amino]acetate
CID 44521769

Frequently Asked Questions

What is the IUPAC name of methyl 2-[bis(2-methylpropyl)amino]acetate?
The IUPAC name of methyl 2-[bis(2-methylpropyl)amino]acetate (CID 18948397) is methyl 2-[bis(2-methylpropyl)amino]acetate.
What is the SMILES notation for methyl 2-[bis(2-methylpropyl)amino]acetate?
The canonical SMILES for methyl 2-[bis(2-methylpropyl)amino]acetate is COC(=O)CN(CC(C)C)CC(C)C.
What is the InChIKey of methyl 2-[bis(2-methylpropyl)amino]acetate?
The InChIKey is UNXHBMFRNPYZKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2/c1-9(2)6-12(7-10(3)4)8-11(13)14-5/h9-10H,6-8H2,1-5H3.
What are the key properties of methyl 2-[bis(2-methylpropyl)amino]acetate?
methyl 2-[bis(2-methylpropyl)amino]acetate has a molecular weight of 201.31 g/mol, XLogP of 1.77, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[bis(2-methylpropyl)amino]acetate is sourced from PubChem (CID 18948397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).