2-(dimethylamino)ethyl N-(2-ethyl-6-methylphenyl)carbamate

C14H22N2O2 — CID 44722433

IUPAC2-(dimethylamino)ethyl N-(2-ethyl-6-methylphenyl)carbamate
SMILESCCc1cccc(C)c1NC(=O)OCCN(C)C
InChIInChI=1S/C14H22N2O2/c1-5-12-8-6-7-11(2)13(12)15-14(17)18-10-9-16(3)4/h6-8H,5,9-10H2,1-4H3,(H,15,17)
InChIKeyVODKONMIOKKKET-UHFFFAOYSA-N
MW250.34 g/mol
LogP2.67
Rot. Bonds5

About 2-(dimethylamino)ethyl N-(2-ethyl-6-methylphenyl)carbamate

2-(dimethylamino)ethyl N-(2-ethyl-6-methylphenyl)carbamate (PubChem CID 44722433) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 2-(dimethylamino)ethyl N-(2-ethyl-6-methylphenyl)carbamate.

Molecular Properties

Compound Name2-(dimethylamino)ethyl N-(2-ethyl-6-methylphenyl)carbamate
PubChem CID44722433
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name2-(dimethylamino)ethyl N-(2-ethyl-6-methylphenyl)carbamate
SMILESCCc1cccc(C)c1NC(=O)OCCN(C)C
InChIInChI=1S/C14H22N2O2/c1-5-12-8-6-7-11(2)13(12)15-14(17)18-10-9-16(3)4/h6-8H,5,9-10H2,1-4H3,(H,15,17)
InChIKeyVODKONMIOKKKET-UHFFFAOYSA-N
XLogP2.67
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,N'-bis(2-ethyl-6-methylphenyl)oxamide
CID 3725747
2-(dimethylamino)ethyl 2-(2,6-diethylanilino)propanoate
CID 20574837
butyl N-(2,6-diethylphenyl)carbamate
CID 19174090
2-[2-(dimethylamino)ethylsulfanyl]-N-(2-ethyl-6-methylphenyl)acetamide
CID 134064956
3-[2-(dimethylamino)ethylamino]-N-(2-ethyl-6-methylphenyl)propanamide
CID 109016429
1-[bis(dimethylamino)methylidene]-3-(2-ethyl-6-methylphenyl)urea
CID 3050633
octadecyl N-(2,6-dimethylphenyl)carbamate
CID 10002058
1-[bis(dimethylamino)methylidene]-3-(2-ethyl-6-methylphenyl)urea;hydrochloride
CID 3050632
[2-(2-ethyl-6-methylanilino)-2-oxoethyl] acetate
CID 2109366
3-N-[2-(dimethylamino)ethyl]-5-N-(2-ethyl-6-methylphenyl)pyridine-3,5-dicarboxamide
CID 109104102
(E)-N,N'-bis(2-ethyl-6-methylphenyl)but-2-enediamide
CID 17407260
2-N-[2-(dimethylamino)ethyl]-1-N-(2-ethyl-6-methylphenyl)cyclopropane-1,2-dicarboxamide
CID 109133722

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)ethyl N-(2-ethyl-6-methylphenyl)carbamate?
The IUPAC name of 2-(dimethylamino)ethyl N-(2-ethyl-6-methylphenyl)carbamate (CID 44722433) is 2-(dimethylamino)ethyl N-(2-ethyl-6-methylphenyl)carbamate.
What is the SMILES notation for 2-(dimethylamino)ethyl N-(2-ethyl-6-methylphenyl)carbamate?
The canonical SMILES for 2-(dimethylamino)ethyl N-(2-ethyl-6-methylphenyl)carbamate is CCc1cccc(C)c1NC(=O)OCCN(C)C.
What is the InChIKey of 2-(dimethylamino)ethyl N-(2-ethyl-6-methylphenyl)carbamate?
The InChIKey is VODKONMIOKKKET-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-5-12-8-6-7-11(2)13(12)15-14(17)18-10-9-16(3)4/h6-8H,5,9-10H2,1-4H3,(H,15,17).
What are the key properties of 2-(dimethylamino)ethyl N-(2-ethyl-6-methylphenyl)carbamate?
2-(dimethylamino)ethyl N-(2-ethyl-6-methylphenyl)carbamate has a molecular weight of 250.34 g/mol, XLogP of 2.67, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)ethyl N-(2-ethyl-6-methylphenyl)carbamate is sourced from PubChem (CID 44722433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).