ethane;N-ethyl-N-[2-[ethyl(methyl)amino]ethyl]benzamide

C16H28N2O — CID 143933020

IUPACethane;N-ethyl-N-[2-[ethyl(methyl)amino]ethyl]benzamide
SMILESCC.CCN(C)CCN(CC)C(=O)c1ccccc1
InChIInChI=1S/C14H22N2O.C2H6/c1-4-15(3)11-12-16(5-2)14(17)13-9-7-6-8-10-13;1-2/h6-10H,4-5,11-12H2,1-3H3;1-2H3
InChIKeyKUWJNTQMQGUESF-UHFFFAOYSA-N
MW264.41 g/mol
LogP3.13
Rot. Bonds6

About ethane;N-ethyl-N-[2-[ethyl(methyl)amino]ethyl]benzamide

ethane;N-ethyl-N-[2-[ethyl(methyl)amino]ethyl]benzamide (PubChem CID 143933020) has the molecular formula C16H28N2O and a molecular weight of 264.41 g/mol. Its IUPAC name is ethane;N-ethyl-N-[2-[ethyl(methyl)amino]ethyl]benzamide.

Molecular Properties

Compound Nameethane;N-ethyl-N-[2-[ethyl(methyl)amino]ethyl]benzamide
PubChem CID143933020
Molecular FormulaC16H28N2O
Molecular Weight264.41 g/mol
Exact Mass264.22
IUPAC Nameethane;N-ethyl-N-[2-[ethyl(methyl)amino]ethyl]benzamide
SMILESCC.CCN(C)CCN(CC)C(=O)c1ccccc1
InChIInChI=1S/C14H22N2O.C2H6/c1-4-15(3)11-12-16(5-2)14(17)13-9-7-6-8-10-13;1-2/h6-10H,4-5,11-12H2,1-3H3;1-2H3
InChIKeyKUWJNTQMQGUESF-UHFFFAOYSA-N
XLogP3.13
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.41
LogP ≤ 53.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

CID 174412487
CID 174412487
N-(2,2-dimethylpropyl)-N-ethylbenzamide;ethane
CID 142910544
N-(2-ethoxyethyl)-N-ethylbenzamide
CID 63718241
N-ethyl-N-[2-(ethylamino)ethyl]benzamide
CID 12892915
tripotassium;N,N-diethylbenzamide;tritetrafluoroborate
CID 121234148
N-[2-(diethylamino)-2-oxoethyl]-N-methylbenzamide
CID 60668984
[4-(diethylcarbamoyl)phenyl] benzoate
CID 139836095
N-[2-(1,3-dioxoisoindol-2-yl)ethyl]-N-ethylbenzamide
CID 102234851
3-[[4-(diethylcarbamoyl)benzoyl]-ethylamino]propanoic acid
CID 120685979
4-[ethyl(propyl)carbamoyl]benzoic acid
CID 43452972
methyl 2-[benzoyl(ethyl)amino]acetate
CID 57002755
3-[benzoyl(ethyl)amino]-2-methylpropanoic acid
CID 62827364

Frequently Asked Questions

What is the IUPAC name of ethane;N-ethyl-N-[2-[ethyl(methyl)amino]ethyl]benzamide?
The IUPAC name of ethane;N-ethyl-N-[2-[ethyl(methyl)amino]ethyl]benzamide (CID 143933020) is ethane;N-ethyl-N-[2-[ethyl(methyl)amino]ethyl]benzamide.
What is the SMILES notation for ethane;N-ethyl-N-[2-[ethyl(methyl)amino]ethyl]benzamide?
The canonical SMILES for ethane;N-ethyl-N-[2-[ethyl(methyl)amino]ethyl]benzamide is CC.CCN(C)CCN(CC)C(=O)c1ccccc1.
What is the InChIKey of ethane;N-ethyl-N-[2-[ethyl(methyl)amino]ethyl]benzamide?
The InChIKey is KUWJNTQMQGUESF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O.C2H6/c1-4-15(3)11-12-16(5-2)14(17)13-9-7-6-8-10-13;1-2/h6-10H,4-5,11-12H2,1-3H3;1-2H3.
What are the key properties of ethane;N-ethyl-N-[2-[ethyl(methyl)amino]ethyl]benzamide?
ethane;N-ethyl-N-[2-[ethyl(methyl)amino]ethyl]benzamide has a molecular weight of 264.41 g/mol, XLogP of 3.13, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-ethyl-N-[2-[ethyl(methyl)amino]ethyl]benzamide is sourced from PubChem (CID 143933020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).