2-[methyl(2-methylpropyl)amino]ethyl N-propylcarbamate

C11H24N2O2 — CID 156523887

IUPAC2-[methyl(2-methylpropyl)amino]ethyl N-propylcarbamate
SMILESCCCNC(=O)OCCN(C)CC(C)C
InChIInChI=1S/C11H24N2O2/c1-5-6-12-11(14)15-8-7-13(4)9-10(2)3/h10H,5-9H2,1-4H3,(H,12,14)
InChIKeyVLPWRVHBVPBBCC-UHFFFAOYSA-N
MW216.32 g/mol
LogP1.71
Rot. Bonds7

About 2-[methyl(2-methylpropyl)amino]ethyl N-propylcarbamate

2-[methyl(2-methylpropyl)amino]ethyl N-propylcarbamate (PubChem CID 156523887) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is 2-[methyl(2-methylpropyl)amino]ethyl N-propylcarbamate.

Molecular Properties

Compound Name2-[methyl(2-methylpropyl)amino]ethyl N-propylcarbamate
PubChem CID156523887
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC Name2-[methyl(2-methylpropyl)amino]ethyl N-propylcarbamate
SMILESCCCNC(=O)OCCN(C)CC(C)C
InChIInChI=1S/C11H24N2O2/c1-5-6-12-11(14)15-8-7-13(4)9-10(2)3/h10H,5-9H2,1-4H3,(H,12,14)
InChIKeyVLPWRVHBVPBBCC-UHFFFAOYSA-N
XLogP1.71
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[methyl(2-methylpropyl)amino]ethyl N-propylcarbamate 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

2-hydroxyethyl N-propylcarbamate
CID 15560805
ethyl N-propylcarbamate
CID 12199
octadecyl N-propylcarbamate
CID 175015942
3-(propylamino)propyl N-propylcarbamate
CID 166733433
3,3-dimethylbutyl N-propylcarbamate
CID 153156945
2-methylbutyl N-propylcarbamate
CID 127538020
2-[2-[ethyl(methyl)amino]ethoxycarbonylamino]ethyl 2-methylprop-2-enoate
CID 174995899
propyl N-(2-methylpropyl)carbamate
CID 91192078
2-(dibutylamino)ethyl N-[6-[2-(dibutylamino)ethoxycarbonylamino]hexyl]carbamate
CID 59782278
dihydroxymethyl N-propylcarbamate
CID 174469308
3-methoxy-1-N-methyl-1-N-(2-methylpropyl)-2-N-propylpropane-1,2-diamine
CID 107505365
2-hydroxyethyl N-(5-methylhexyl)carbamate
CID 115327389

Frequently Asked Questions

What is the IUPAC name of 2-[methyl(2-methylpropyl)amino]ethyl N-propylcarbamate?
The IUPAC name of 2-[methyl(2-methylpropyl)amino]ethyl N-propylcarbamate (CID 156523887) is 2-[methyl(2-methylpropyl)amino]ethyl N-propylcarbamate.
What is the SMILES notation for 2-[methyl(2-methylpropyl)amino]ethyl N-propylcarbamate?
The canonical SMILES for 2-[methyl(2-methylpropyl)amino]ethyl N-propylcarbamate is CCCNC(=O)OCCN(C)CC(C)C.
What is the InChIKey of 2-[methyl(2-methylpropyl)amino]ethyl N-propylcarbamate?
The InChIKey is VLPWRVHBVPBBCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-5-6-12-11(14)15-8-7-13(4)9-10(2)3/h10H,5-9H2,1-4H3,(H,12,14).
What are the key properties of 2-[methyl(2-methylpropyl)amino]ethyl N-propylcarbamate?
2-[methyl(2-methylpropyl)amino]ethyl N-propylcarbamate has a molecular weight of 216.32 g/mol, XLogP of 1.71, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl(2-methylpropyl)amino]ethyl N-propylcarbamate is sourced from PubChem (CID 156523887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).