N-[2-(cycloheptylamino)ethyl]-2-(2-ethoxyethoxy)benzamide;hydrochloride

C20H33ClN2O3 — CID 119620824

IUPACN-[2-(cycloheptylamino)ethyl]-2-(2-ethoxyethoxy)benzamide;hydrochloride
SMILESCCOCCOc1ccccc1C(=O)NCCNC1CCCCCC1.Cl
InChIInChI=1S/C20H32N2O3.ClH/c1-2-24-15-16-25-19-12-8-7-11-18(19)20(23)22-14-13-21-17-9-5-3-4-6-10-17;/h7-8,11-12,17,21H,2-6,9-10,13-16H2,1H3,(H,22,23);1H
InChIKeyUSWFDKOIXRLUGK-UHFFFAOYSA-N
MW384.95 g/mol
LogP3.57
Rot. Bonds10

About N-[2-(cycloheptylamino)ethyl]-2-(2-ethoxyethoxy)benzamide;hydrochloride

N-[2-(cycloheptylamino)ethyl]-2-(2-ethoxyethoxy)benzamide;hydrochloride (PubChem CID 119620824) has the molecular formula C20H33ClN2O3 and a molecular weight of 384.95 g/mol. Its IUPAC name is N-[2-(cycloheptylamino)ethyl]-2-(2-ethoxyethoxy)benzamide;hydrochloride.

Molecular Properties

Compound NameN-[2-(cycloheptylamino)ethyl]-2-(2-ethoxyethoxy)benzamide;hydrochloride
PubChem CID119620824
Molecular FormulaC20H33ClN2O3
Molecular Weight384.95 g/mol
Exact Mass384.22
IUPAC NameN-[2-(cycloheptylamino)ethyl]-2-(2-ethoxyethoxy)benzamide;hydrochloride
SMILESCCOCCOc1ccccc1C(=O)NCCNC1CCCCCC1.Cl
InChIInChI=1S/C20H32N2O3.ClH/c1-2-24-15-16-25-19-12-8-7-11-18(19)20(23)22-14-13-21-17-9-5-3-4-6-10-17;/h7-8,11-12,17,21H,2-6,9-10,13-16H2,1H3,(H,22,23);1H
InChIKeyUSWFDKOIXRLUGK-UHFFFAOYSA-N
XLogP3.57
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.95
LogP ≤ 53.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-[2-(cycloheptylamino)ethyl]-2-(2-ethoxyethoxy)benzamide;hydrochloride 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-(cycloheptylamino)ethyl]-2-ethoxybenzamide;hydrochloride
CID 119620937
N-[2-(cycloheptylamino)ethyl]-2-methoxybenzamide
CID 81487134
N-(cyclohexylcarbamothioyl)-2-(2-ethoxyethoxy)benzamide
CID 17123003
N-[2-(cyclopropylamino)ethyl]-2-methoxybenzamide
CID 62665285
2-(2-ethoxyethoxy)-N-(pyrrolidin-2-ylmethyl)benzamide
CID 119513373
N-[2-(4-aminophenyl)ethyl]-2-(2-ethoxyethoxy)benzamide;hydrochloride
CID 119549073
N-[4-(cyclohexylamino)-4-oxobutyl]-2-ethoxybenzamide
CID 51237421
4-[[[2-(2-ethoxyethoxy)benzoyl]amino]methyl]benzoic acid
CID 119165428
N-[2-(cycloheptylamino)ethyl]-2-nitrobenzamide;hydrochloride
CID 91645413
N-[2-(cycloheptylamino)ethyl]-2-fluoro-6-methoxybenzamide
CID 119619869
N-[2-(cycloheptylamino)ethyl]-4-ethoxybutanamide;hydrochloride
CID 119619598
N-[2-(cycloheptylamino)ethyl]-2-(trifluoromethyl)benzamide
CID 119619762

Frequently Asked Questions

What is the IUPAC name of N-[2-(cycloheptylamino)ethyl]-2-(2-ethoxyethoxy)benzamide;hydrochloride?
The IUPAC name of N-[2-(cycloheptylamino)ethyl]-2-(2-ethoxyethoxy)benzamide;hydrochloride (CID 119620824) is N-[2-(cycloheptylamino)ethyl]-2-(2-ethoxyethoxy)benzamide;hydrochloride.
What is the SMILES notation for N-[2-(cycloheptylamino)ethyl]-2-(2-ethoxyethoxy)benzamide;hydrochloride?
The canonical SMILES for N-[2-(cycloheptylamino)ethyl]-2-(2-ethoxyethoxy)benzamide;hydrochloride is CCOCCOc1ccccc1C(=O)NCCNC1CCCCCC1.Cl.
What is the InChIKey of N-[2-(cycloheptylamino)ethyl]-2-(2-ethoxyethoxy)benzamide;hydrochloride?
The InChIKey is USWFDKOIXRLUGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H32N2O3.ClH/c1-2-24-15-16-25-19-12-8-7-11-18(19)20(23)22-14-13-21-17-9-5-3-4-6-10-17;/h7-8,11-12,17,21H,2-6,9-10,13-16H2,1H3,(H,22,23);1H.
What are the key properties of N-[2-(cycloheptylamino)ethyl]-2-(2-ethoxyethoxy)benzamide;hydrochloride?
N-[2-(cycloheptylamino)ethyl]-2-(2-ethoxyethoxy)benzamide;hydrochloride has a molecular weight of 384.95 g/mol, XLogP of 3.57, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cycloheptylamino)ethyl]-2-(2-ethoxyethoxy)benzamide;hydrochloride is sourced from PubChem (CID 119620824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).