N-[2-(cyclopropylcarbamoylamino)ethyl]-N-(2-ethylphenyl)acetamide

C16H23N3O2 — CID 113058350

IUPACN-[2-(cyclopropylcarbamoylamino)ethyl]-N-(2-ethylphenyl)acetamide
SMILESCCc1ccccc1N(CCNC(=O)NC1CC1)C(C)=O
InChIInChI=1S/C16H23N3O2/c1-3-13-6-4-5-7-15(13)19(12(2)20)11-10-17-16(21)18-14-8-9-14/h4-7,14H,3,8-11H2,1-2H3,(H2,17,18,21)
InChIKeyGRSWAULBAPOLQC-UHFFFAOYSA-N
MW289.38 g/mol
LogP2.06
Rot. Bonds6

About N-[2-(cyclopropylcarbamoylamino)ethyl]-N-(2-ethylphenyl)acetamide

N-[2-(cyclopropylcarbamoylamino)ethyl]-N-(2-ethylphenyl)acetamide (PubChem CID 113058350) has the molecular formula C16H23N3O2 and a molecular weight of 289.38 g/mol. Its IUPAC name is N-[2-(cyclopropylcarbamoylamino)ethyl]-N-(2-ethylphenyl)acetamide.

Molecular Properties

Compound NameN-[2-(cyclopropylcarbamoylamino)ethyl]-N-(2-ethylphenyl)acetamide
PubChem CID113058350
Molecular FormulaC16H23N3O2
Molecular Weight289.38 g/mol
Exact Mass289.18
IUPAC NameN-[2-(cyclopropylcarbamoylamino)ethyl]-N-(2-ethylphenyl)acetamide
SMILESCCc1ccccc1N(CCNC(=O)NC1CC1)C(C)=O
InChIInChI=1S/C16H23N3O2/c1-3-13-6-4-5-7-15(13)19(12(2)20)11-10-17-16(21)18-14-8-9-14/h4-7,14H,3,8-11H2,1-2H3,(H2,17,18,21)
InChIKeyGRSWAULBAPOLQC-UHFFFAOYSA-N
XLogP2.06
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-(N-acetyl-2-ethylanilino)-N-cyclopropylpropanamide
CID 113125154
N-[2-(cyclohexylcarbamoylamino)ethyl]-N-(2-ethoxyphenyl)acetamide
CID 113060789
N-[2-(N-acetyl-2-ethylanilino)ethyl]cyclohexanecarboxamide
CID 113058289
N-[2-(cyclohexylcarbamoylamino)ethyl]-N-phenylacetamide
CID 113057217
N-[2-(cyclopropylcarbamoylamino)ethyl]-N-(2,4-difluorophenyl)acetamide
CID 113063349
N-[2-(cyclopropylcarbamoylamino)ethyl]-N-[(2-fluorophenyl)methyl]acetamide
CID 113054591
N-[(2-chlorophenyl)methyl]-N-[2-(cyclopropylcarbamoylamino)ethyl]acetamide
CID 113054795
N-[2-(N-acetyl-2-ethylanilino)ethyl]-2-phenylacetamide
CID 113058316
N-(4-bromo-2-methylphenyl)-N-[2-(cyclopropylcarbamoylamino)ethyl]acetamide
CID 113062891
N-[2-(cyclopropylcarbamoylamino)ethyl]-N-(4-fluorophenyl)acetamide
CID 113059350
N-[2-(cyclopropylcarbamoylamino)ethyl]-N-(3,5-dimethylphenyl)acetamide
CID 113058035
N-[2-(N-acetyl-2-ethylanilino)ethyl]pentanamide
CID 113058287

Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclopropylcarbamoylamino)ethyl]-N-(2-ethylphenyl)acetamide?
The IUPAC name of N-[2-(cyclopropylcarbamoylamino)ethyl]-N-(2-ethylphenyl)acetamide (CID 113058350) is N-[2-(cyclopropylcarbamoylamino)ethyl]-N-(2-ethylphenyl)acetamide.
What is the SMILES notation for N-[2-(cyclopropylcarbamoylamino)ethyl]-N-(2-ethylphenyl)acetamide?
The canonical SMILES for N-[2-(cyclopropylcarbamoylamino)ethyl]-N-(2-ethylphenyl)acetamide is CCc1ccccc1N(CCNC(=O)NC1CC1)C(C)=O.
What is the InChIKey of N-[2-(cyclopropylcarbamoylamino)ethyl]-N-(2-ethylphenyl)acetamide?
The InChIKey is GRSWAULBAPOLQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O2/c1-3-13-6-4-5-7-15(13)19(12(2)20)11-10-17-16(21)18-14-8-9-14/h4-7,14H,3,8-11H2,1-2H3,(H2,17,18,21).
What are the key properties of N-[2-(cyclopropylcarbamoylamino)ethyl]-N-(2-ethylphenyl)acetamide?
N-[2-(cyclopropylcarbamoylamino)ethyl]-N-(2-ethylphenyl)acetamide has a molecular weight of 289.38 g/mol, XLogP of 2.06, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclopropylcarbamoylamino)ethyl]-N-(2-ethylphenyl)acetamide is sourced from PubChem (CID 113058350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).