N-(2-aminoethyl)-N-ethyl-2,4,5-trimethyloxolane-3-carboxamide

C12H24N2O2 — CID 65152023

IUPACN-(2-aminoethyl)-N-ethyl-2,4,5-trimethyloxolane-3-carboxamide
SMILESCCN(CCN)C(=O)C1C(C)OC(C)C1C
InChIInChI=1S/C12H24N2O2/c1-5-14(7-6-13)12(15)11-8(2)9(3)16-10(11)4/h8-11H,5-7,13H2,1-4H3
InChIKeyUMPZAZOLDKXMTI-UHFFFAOYSA-N
MW228.34 g/mol
LogP0.85
Rot. Bonds4

About N-(2-aminoethyl)-N-ethyl-2,4,5-trimethyloxolane-3-carboxamide

N-(2-aminoethyl)-N-ethyl-2,4,5-trimethyloxolane-3-carboxamide (PubChem CID 65152023) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is N-(2-aminoethyl)-N-ethyl-2,4,5-trimethyloxolane-3-carboxamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-N-ethyl-2,4,5-trimethyloxolane-3-carboxamide
PubChem CID65152023
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC NameN-(2-aminoethyl)-N-ethyl-2,4,5-trimethyloxolane-3-carboxamide
SMILESCCN(CCN)C(=O)C1C(C)OC(C)C1C
InChIInChI=1S/C12H24N2O2/c1-5-14(7-6-13)12(15)11-8(2)9(3)16-10(11)4/h8-11H,5-7,13H2,1-4H3
InChIKeyUMPZAZOLDKXMTI-UHFFFAOYSA-N
XLogP0.85
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 3-[ethyl-(2,4,5-trimethyloxolane-3-carbonyl)amino]propanoate
CID 65160102
N-(3-aminopropyl)-2,4,5-trimethyl-N-propyloxolane-3-carboxamide
CID 65152019
N-(3-aminopropyl)-2,4,5-trimethyl-N-(2-methylpropyl)oxolane-3-carboxamide
CID 65152273
methyl 2-[propyl-(2,4,5-trimethyloxolane-3-carbonyl)amino]acetate
CID 65160300
2-[2-methoxyethyl-(2,4,5-trimethyloxolane-3-carbonyl)amino]acetic acid
CID 65157378
N-(4-aminophenyl)-N-ethyl-2,4,5-trimethyloxolane-3-carboxamide
CID 65156880
2,4,5-trimethyl-N-(piperidin-2-ylmethyl)-N-propyloxolane-3-carboxamide
CID 106625536
N-(2-aminoethyl)-N-ethylacetamide
CID 23084474
(2S,3S)-N,N-diethyl-3-methyloxirane-2-carboxamide
CID 45084480
N-(1-cyanopropan-2-yl)-N,2,4,5-tetramethyloxolane-3-carboxamide
CID 65156263
N-(1-aminopentan-3-yl)-2,4,5-trimethyloxolane-3-carboxamide
CID 65152668
N-(3-chloropropyl)-2,4,5-trimethyl-N-propan-2-yloxolane-3-carboxamide
CID 65159286

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-N-ethyl-2,4,5-trimethyloxolane-3-carboxamide?
The IUPAC name of N-(2-aminoethyl)-N-ethyl-2,4,5-trimethyloxolane-3-carboxamide (CID 65152023) is N-(2-aminoethyl)-N-ethyl-2,4,5-trimethyloxolane-3-carboxamide.
What is the SMILES notation for N-(2-aminoethyl)-N-ethyl-2,4,5-trimethyloxolane-3-carboxamide?
The canonical SMILES for N-(2-aminoethyl)-N-ethyl-2,4,5-trimethyloxolane-3-carboxamide is CCN(CCN)C(=O)C1C(C)OC(C)C1C.
What is the InChIKey of N-(2-aminoethyl)-N-ethyl-2,4,5-trimethyloxolane-3-carboxamide?
The InChIKey is UMPZAZOLDKXMTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-5-14(7-6-13)12(15)11-8(2)9(3)16-10(11)4/h8-11H,5-7,13H2,1-4H3.
What are the key properties of N-(2-aminoethyl)-N-ethyl-2,4,5-trimethyloxolane-3-carboxamide?
N-(2-aminoethyl)-N-ethyl-2,4,5-trimethyloxolane-3-carboxamide has a molecular weight of 228.34 g/mol, XLogP of 0.85, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-N-ethyl-2,4,5-trimethyloxolane-3-carboxamide is sourced from PubChem (CID 65152023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).