N-[2-(2,6-dimethylanilino)-2-oxoethyl]-N-ethyl-2-hydroxycyclopentane-1-carboxamide

C18H26N2O3 — CID 110015978

IUPACN-[2-(2,6-dimethylanilino)-2-oxoethyl]-N-ethyl-2-hydroxycyclopentane-1-carboxamide
SMILESCCN(CC(=O)Nc1c(C)cccc1C)C(=O)C1CCCC1O
InChIInChI=1S/C18H26N2O3/c1-4-20(18(23)14-9-6-10-15(14)21)11-16(22)19-17-12(2)7-5-8-13(17)3/h5,7-8,14-15,21H,4,6,9-11H2,1-3H3,(H,19,22)
InChIKeyRWZNHFHWYKYELZ-UHFFFAOYSA-N
MW318.42 g/mol
LogP2.25
Rot. Bonds5

About N-[2-(2,6-dimethylanilino)-2-oxoethyl]-N-ethyl-2-hydroxycyclopentane-1-carboxamide

N-[2-(2,6-dimethylanilino)-2-oxoethyl]-N-ethyl-2-hydroxycyclopentane-1-carboxamide (PubChem CID 110015978) has the molecular formula C18H26N2O3 and a molecular weight of 318.42 g/mol. Its IUPAC name is N-[2-(2,6-dimethylanilino)-2-oxoethyl]-N-ethyl-2-hydroxycyclopentane-1-carboxamide.

Molecular Properties

Compound NameN-[2-(2,6-dimethylanilino)-2-oxoethyl]-N-ethyl-2-hydroxycyclopentane-1-carboxamide
PubChem CID110015978
Molecular FormulaC18H26N2O3
Molecular Weight318.42 g/mol
Exact Mass318.19
IUPAC NameN-[2-(2,6-dimethylanilino)-2-oxoethyl]-N-ethyl-2-hydroxycyclopentane-1-carboxamide
SMILESCCN(CC(=O)Nc1c(C)cccc1C)C(=O)C1CCCC1O
InChIInChI=1S/C18H26N2O3/c1-4-20(18(23)14-9-6-10-15(14)21)11-16(22)19-17-12(2)7-5-8-13(17)3/h5,7-8,14-15,21H,4,6,9-11H2,1-3H3,(H,19,22)
InChIKeyRWZNHFHWYKYELZ-UHFFFAOYSA-N
XLogP2.25
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.42
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(2,6-dimethylanilino)-2-oxoethyl]-N-ethylpiperidine-2-carboxamide;hydrochloride
CID 119335151
(2S,5R)-5-(aminomethyl)-N-[2-(2,6-dimethylanilino)-2-oxoethyl]-N-ethyloxolane-2-carboxamide;hydrochloride
CID 120794955
N-(2-ethyl-6-methylphenyl)-2-hydroxycyclopentane-1-carboxamide
CID 110015386
bis(2-(diethylamino)-N-(2,6-dimethylphenyl)acetamide);dihydrochloride
CID 69335483
CID 89442401
CID 89442401
cis-(1R,2S)-N-[2-(2,6-dimethylanilino)-2-oxoethyl]-N,2-dimethylcyclopropane-1-carboxamide
CID 2650123
1-N,1-N-diethyl-2-N-(2-ethyl-6-methylphenyl)cyclopropane-1,2-dicarboxamide
CID 109139318
N-[2-(2,6-dimethylanilino)-2-oxoethyl]-N-ethyl-2-hydroxy-2,2-diphenylacetamide
CID 167875350
3-[cyclopropyl-[2-(2,6-dimethylanilino)-2-oxoethyl]amino]-N-ethyl-N-(2-hydroxyethyl)propanamide
CID 84562403
2-[acetyl(cyclohexyl)amino]-N-(2-ethyl-6-methylphenyl)acetamide
CID 113159510
2-(diethylamino)-N-(2,6-dimethylphenyl)acetamide;formic acid
CID 166652856
4-[[2-(2,6-dimethylanilino)-2-oxoethyl]-methylcarbamoyl]cyclohexane-1-carboxylic acid
CID 120672752

Frequently Asked Questions

What is the IUPAC name of N-[2-(2,6-dimethylanilino)-2-oxoethyl]-N-ethyl-2-hydroxycyclopentane-1-carboxamide?
The IUPAC name of N-[2-(2,6-dimethylanilino)-2-oxoethyl]-N-ethyl-2-hydroxycyclopentane-1-carboxamide (CID 110015978) is N-[2-(2,6-dimethylanilino)-2-oxoethyl]-N-ethyl-2-hydroxycyclopentane-1-carboxamide.
What is the SMILES notation for N-[2-(2,6-dimethylanilino)-2-oxoethyl]-N-ethyl-2-hydroxycyclopentane-1-carboxamide?
The canonical SMILES for N-[2-(2,6-dimethylanilino)-2-oxoethyl]-N-ethyl-2-hydroxycyclopentane-1-carboxamide is CCN(CC(=O)Nc1c(C)cccc1C)C(=O)C1CCCC1O.
What is the InChIKey of N-[2-(2,6-dimethylanilino)-2-oxoethyl]-N-ethyl-2-hydroxycyclopentane-1-carboxamide?
The InChIKey is RWZNHFHWYKYELZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O3/c1-4-20(18(23)14-9-6-10-15(14)21)11-16(22)19-17-12(2)7-5-8-13(17)3/h5,7-8,14-15,21H,4,6,9-11H2,1-3H3,(H,19,22).
What are the key properties of N-[2-(2,6-dimethylanilino)-2-oxoethyl]-N-ethyl-2-hydroxycyclopentane-1-carboxamide?
N-[2-(2,6-dimethylanilino)-2-oxoethyl]-N-ethyl-2-hydroxycyclopentane-1-carboxamide has a molecular weight of 318.42 g/mol, XLogP of 2.25, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,6-dimethylanilino)-2-oxoethyl]-N-ethyl-2-hydroxycyclopentane-1-carboxamide is sourced from PubChem (CID 110015978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).