N-(2-amino-1-cyclohexylethyl)-2-(2-amino-2-oxoethoxy)benzamide

C17H25N3O3 — CID 119591890

IUPACN-(2-amino-1-cyclohexylethyl)-2-(2-amino-2-oxoethoxy)benzamide
SMILESNCC(NC(=O)c1ccccc1OCC(N)=O)C1CCCCC1
InChIInChI=1S/C17H25N3O3/c18-10-14(12-6-2-1-3-7-12)20-17(22)13-8-4-5-9-15(13)23-11-16(19)21/h4-5,8-9,12,14H,1-3,6-7,10-11,18H2,(H2,19,21)(H,20,22)
InChIKeySJVYNLIEYYZIHK-UHFFFAOYSA-N
MW319.41 g/mol
LogP1.19
Rot. Bonds7

About N-(2-amino-1-cyclohexylethyl)-2-(2-amino-2-oxoethoxy)benzamide

N-(2-amino-1-cyclohexylethyl)-2-(2-amino-2-oxoethoxy)benzamide (PubChem CID 119591890) has the molecular formula C17H25N3O3 and a molecular weight of 319.41 g/mol. Its IUPAC name is N-(2-amino-1-cyclohexylethyl)-2-(2-amino-2-oxoethoxy)benzamide.

Molecular Properties

Compound NameN-(2-amino-1-cyclohexylethyl)-2-(2-amino-2-oxoethoxy)benzamide
PubChem CID119591890
Molecular FormulaC17H25N3O3
Molecular Weight319.41 g/mol
Exact Mass319.19
IUPAC NameN-(2-amino-1-cyclohexylethyl)-2-(2-amino-2-oxoethoxy)benzamide
SMILESNCC(NC(=O)c1ccccc1OCC(N)=O)C1CCCCC1
InChIInChI=1S/C17H25N3O3/c18-10-14(12-6-2-1-3-7-12)20-17(22)13-8-4-5-9-15(13)23-11-16(19)21/h4-5,8-9,12,14H,1-3,6-7,10-11,18H2,(H2,19,21)(H,20,22)
InChIKeySJVYNLIEYYZIHK-UHFFFAOYSA-N
XLogP1.19
TPSA107.44 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.41
LogP ≤ 51.19
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-(2-amino-1-cyclohexylethyl)-2-(2-amino-2-oxoethoxy)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-amino-1-cyclopropylethyl)-2-ethoxybenzamide;hydrochloride
CID 119616625
N-(2-amino-1-cyclohexylethyl)-2-chlorobenzamide
CID 81487183
N-(2-amino-1-cyclohexylethyl)-2-iodobenzamide
CID 81487660
N-(2-amino-1-cyclopropylethyl)-2-methoxybenzamide
CID 65188794
N-(2-amino-1-cyclohexylethyl)-2-(2-amino-2-oxoethyl)sulfanylbenzamide;hydrochloride
CID 119589063
N-(2-amino-1-cyclohexylethyl)-2-methylbenzamide;hydrochloride
CID 119588952
N-(2-amino-1-cyclohexylethyl)-2,3-dimethoxybenzamide;hydrochloride
CID 119591832
N-(2-amino-1-cyclopropylethyl)-2-[(4-bromophenyl)methoxy]benzamide
CID 119616898
N-(2-amino-1-cyclopropylethyl)-2-[(2-methylphenyl)methoxy]benzamide;hydrochloride
CID 119616996
N-(2-amino-1-cyclohexylethyl)-2-methylpyridine-3-carboxamide
CID 81485625
N-[2-(aminomethyl)cyclopentyl]-2-(2-amino-2-oxoethoxy)benzamide
CID 119604933
N-(2-amino-1-cyclopentylethyl)-2-(trifluoromethyl)benzamide
CID 106737225

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1-cyclohexylethyl)-2-(2-amino-2-oxoethoxy)benzamide?
The IUPAC name of N-(2-amino-1-cyclohexylethyl)-2-(2-amino-2-oxoethoxy)benzamide (CID 119591890) is N-(2-amino-1-cyclohexylethyl)-2-(2-amino-2-oxoethoxy)benzamide.
What is the SMILES notation for N-(2-amino-1-cyclohexylethyl)-2-(2-amino-2-oxoethoxy)benzamide?
The canonical SMILES for N-(2-amino-1-cyclohexylethyl)-2-(2-amino-2-oxoethoxy)benzamide is NCC(NC(=O)c1ccccc1OCC(N)=O)C1CCCCC1.
What is the InChIKey of N-(2-amino-1-cyclohexylethyl)-2-(2-amino-2-oxoethoxy)benzamide?
The InChIKey is SJVYNLIEYYZIHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O3/c18-10-14(12-6-2-1-3-7-12)20-17(22)13-8-4-5-9-15(13)23-11-16(19)21/h4-5,8-9,12,14H,1-3,6-7,10-11,18H2,(H2,19,21)(H,20,22).
What are the key properties of N-(2-amino-1-cyclohexylethyl)-2-(2-amino-2-oxoethoxy)benzamide?
N-(2-amino-1-cyclohexylethyl)-2-(2-amino-2-oxoethoxy)benzamide has a molecular weight of 319.41 g/mol, XLogP of 1.19, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-1-cyclohexylethyl)-2-(2-amino-2-oxoethoxy)benzamide is sourced from PubChem (CID 119591890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).