N-[2-(N-acetyl-2-ethylanilino)ethyl]cyclohexanecarboxamide

C19H28N2O2 — CID 113058289

IUPACN-[2-(N-acetyl-2-ethylanilino)ethyl]cyclohexanecarboxamide
SMILESCCc1ccccc1N(CCNC(=O)C1CCCCC1)C(C)=O
InChIInChI=1S/C19H28N2O2/c1-3-16-9-7-8-12-18(16)21(15(2)22)14-13-20-19(23)17-10-5-4-6-11-17/h7-9,12,17H,3-6,10-11,13-14H2,1-2H3,(H,20,23)
InChIKeyHHVDJCJKAKBDAP-UHFFFAOYSA-N
MW316.44 g/mol
LogP3.30
Rot. Bonds6

About N-[2-(N-acetyl-2-ethylanilino)ethyl]cyclohexanecarboxamide

N-[2-(N-acetyl-2-ethylanilino)ethyl]cyclohexanecarboxamide (PubChem CID 113058289) has the molecular formula C19H28N2O2 and a molecular weight of 316.44 g/mol. Its IUPAC name is N-[2-(N-acetyl-2-ethylanilino)ethyl]cyclohexanecarboxamide.

Molecular Properties

Compound NameN-[2-(N-acetyl-2-ethylanilino)ethyl]cyclohexanecarboxamide
PubChem CID113058289
Molecular FormulaC19H28N2O2
Molecular Weight316.44 g/mol
Exact Mass316.22
IUPAC NameN-[2-(N-acetyl-2-ethylanilino)ethyl]cyclohexanecarboxamide
SMILESCCc1ccccc1N(CCNC(=O)C1CCCCC1)C(C)=O
InChIInChI=1S/C19H28N2O2/c1-3-16-9-7-8-12-18(16)21(15(2)22)14-13-20-19(23)17-10-5-4-6-11-17/h7-9,12,17H,3-6,10-11,13-14H2,1-2H3,(H,20,23)
InChIKeyHHVDJCJKAKBDAP-UHFFFAOYSA-N
XLogP3.30
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.44
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(N-acetyl-2-bromoanilino)ethyl]cyclohexanecarboxamide
CID 113062722
N-[2-(cyclopropylcarbamoylamino)ethyl]-N-(2-ethylphenyl)acetamide
CID 113058350
N-[2-(N-acetyl-4-tert-butylanilino)ethyl]cyclohexanecarboxamide
CID 113059086
N-[2-(N-acetyl-2-ethylanilino)ethyl]-2-phenylacetamide
CID 113058316
N-[2-(N-acetyl-2-methoxy-5-methylanilino)ethyl]cyclohexanecarboxamide
CID 113060920
N-[2-(N-acetyl-3,4-dichloroanilino)ethyl]cyclohexanecarboxamide
CID 113063535
N-[2-(N-acetyl-2-ethylanilino)ethyl]pentanamide
CID 113058287
N-[2-(N,4-diacetylanilino)ethyl]cyclobutanecarboxamide
CID 113061690
N-[2-(N-acetyl-2,6-dimethylanilino)ethyl]cyclopropanecarboxamide
CID 113058076
3-(N-acetyl-2-ethylanilino)-N-cyclopropylpropanamide
CID 113125154
N-[2-(N-acetyl-2-ethylanilino)ethyl]thiophene-2-carboxamide
CID 113058294
N-[2-(2-chloro-N-methylsulfonylanilino)ethyl]cyclohexanecarboxamide
CID 113069805

Frequently Asked Questions

What is the IUPAC name of N-[2-(N-acetyl-2-ethylanilino)ethyl]cyclohexanecarboxamide?
The IUPAC name of N-[2-(N-acetyl-2-ethylanilino)ethyl]cyclohexanecarboxamide (CID 113058289) is N-[2-(N-acetyl-2-ethylanilino)ethyl]cyclohexanecarboxamide.
What is the SMILES notation for N-[2-(N-acetyl-2-ethylanilino)ethyl]cyclohexanecarboxamide?
The canonical SMILES for N-[2-(N-acetyl-2-ethylanilino)ethyl]cyclohexanecarboxamide is CCc1ccccc1N(CCNC(=O)C1CCCCC1)C(C)=O.
What is the InChIKey of N-[2-(N-acetyl-2-ethylanilino)ethyl]cyclohexanecarboxamide?
The InChIKey is HHVDJCJKAKBDAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2O2/c1-3-16-9-7-8-12-18(16)21(15(2)22)14-13-20-19(23)17-10-5-4-6-11-17/h7-9,12,17H,3-6,10-11,13-14H2,1-2H3,(H,20,23).
What are the key properties of N-[2-(N-acetyl-2-ethylanilino)ethyl]cyclohexanecarboxamide?
N-[2-(N-acetyl-2-ethylanilino)ethyl]cyclohexanecarboxamide has a molecular weight of 316.44 g/mol, XLogP of 3.30, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(N-acetyl-2-ethylanilino)ethyl]cyclohexanecarboxamide is sourced from PubChem (CID 113058289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).