N-cycloheptyl-2-(N-ethyl-3-methylanilino)acetamide

C18H28N2O — CID 109005664

IUPACN-cycloheptyl-2-(N-ethyl-3-methylanilino)acetamide
SMILESCCN(CC(=O)NC1CCCCCC1)c1cccc(C)c1
InChIInChI=1S/C18H28N2O/c1-3-20(17-12-8-9-15(2)13-17)14-18(21)19-16-10-6-4-5-7-11-16/h8-9,12-13,16H,3-7,10-11,14H2,1-2H3,(H,19,21)
InChIKeyBLETYCDGWKVPIU-UHFFFAOYSA-N
MW288.44 g/mol
LogP3.66
Rot. Bonds5

About N-cycloheptyl-2-(N-ethyl-3-methylanilino)acetamide

N-cycloheptyl-2-(N-ethyl-3-methylanilino)acetamide (PubChem CID 109005664) has the molecular formula C18H28N2O and a molecular weight of 288.44 g/mol. Its IUPAC name is N-cycloheptyl-2-(N-ethyl-3-methylanilino)acetamide.

Molecular Properties

Compound NameN-cycloheptyl-2-(N-ethyl-3-methylanilino)acetamide
PubChem CID109005664
Molecular FormulaC18H28N2O
Molecular Weight288.44 g/mol
Exact Mass288.22
IUPAC NameN-cycloheptyl-2-(N-ethyl-3-methylanilino)acetamide
SMILESCCN(CC(=O)NC1CCCCCC1)c1cccc(C)c1
InChIInChI=1S/C18H28N2O/c1-3-20(17-12-8-9-15(2)13-17)14-18(21)19-16-10-6-4-5-7-11-16/h8-9,12-13,16H,3-7,10-11,14H2,1-2H3,(H,19,21)
InChIKeyBLETYCDGWKVPIU-UHFFFAOYSA-N
XLogP3.66
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.44
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-amino-N-ethylanilino)-N-cyclopentylacetamide
CID 55175748
1-cyclopentyl-2-(N-ethyl-3-methylanilino)ethanone
CID 104750103
N-cyclopentyl-N'-ethyl-N'-(3-methylphenyl)propanediamide
CID 108942305
N-cyclohexyl-2-(3-methylphenyl)acetamide
CID 6467373
2-(N-acetyl-3-methylanilino)-N-cyclopropylacetamide
CID 113167455
N-cyclopropyl-N'-ethyl-N'-(3-methylphenyl)propanediamide
CID 108941153
N-(cyclopentylcarbamoyl)-N-(3-methylphenyl)acetamide
CID 86239895
N-cyclopentyl-2-(N-ethyl-3-methylanilino)-2-phenylacetamide
CID 4177926
N-(2,6-difluorophenyl)-2-(N-ethyl-3-methylanilino)acetamide
CID 109011313
N-cyclohexyl-2-(N-[2-[2-(4-fluoroanilino)-2-oxoethyl]sulfinylacetyl]-3-methylanilino)acetamide
CID 3182279
N-(3-chlorophenyl)-2-(N-ethyl-3-methylanilino)acetamide
CID 109008467
N-cyclopentyl-2-[N-(2-hydroxybutyl)anilino]acetamide
CID 51108555

Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-2-(N-ethyl-3-methylanilino)acetamide?
The IUPAC name of N-cycloheptyl-2-(N-ethyl-3-methylanilino)acetamide (CID 109005664) is N-cycloheptyl-2-(N-ethyl-3-methylanilino)acetamide.
What is the SMILES notation for N-cycloheptyl-2-(N-ethyl-3-methylanilino)acetamide?
The canonical SMILES for N-cycloheptyl-2-(N-ethyl-3-methylanilino)acetamide is CCN(CC(=O)NC1CCCCCC1)c1cccc(C)c1.
What is the InChIKey of N-cycloheptyl-2-(N-ethyl-3-methylanilino)acetamide?
The InChIKey is BLETYCDGWKVPIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O/c1-3-20(17-12-8-9-15(2)13-17)14-18(21)19-16-10-6-4-5-7-11-16/h8-9,12-13,16H,3-7,10-11,14H2,1-2H3,(H,19,21).
What are the key properties of N-cycloheptyl-2-(N-ethyl-3-methylanilino)acetamide?
N-cycloheptyl-2-(N-ethyl-3-methylanilino)acetamide has a molecular weight of 288.44 g/mol, XLogP of 3.66, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-2-(N-ethyl-3-methylanilino)acetamide is sourced from PubChem (CID 109005664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).