4-(cyclohexylmethoxy)-N-(2-piperazin-1-ylethyl)benzamide

C20H31N3O2 — CID 119448595

IUPAC4-(cyclohexylmethoxy)-N-(2-piperazin-1-ylethyl)benzamide
SMILESO=C(NCCN1CCNCC1)c1ccc(OCC2CCCCC2)cc1
InChIInChI=1S/C20H31N3O2/c24-20(22-12-15-23-13-10-21-11-14-23)18-6-8-19(9-7-18)25-16-17-4-2-1-3-5-17/h6-9,17,21H,1-5,10-16H2,(H,22,24)
InChIKeyLVMGHUJONLIYPG-UHFFFAOYSA-N
MW345.49 g/mol
LogP2.28
Rot. Bonds7

About 4-(cyclohexylmethoxy)-N-(2-piperazin-1-ylethyl)benzamide

4-(cyclohexylmethoxy)-N-(2-piperazin-1-ylethyl)benzamide (PubChem CID 119448595) has the molecular formula C20H31N3O2 and a molecular weight of 345.49 g/mol. Its IUPAC name is 4-(cyclohexylmethoxy)-N-(2-piperazin-1-ylethyl)benzamide.

Molecular Properties

Compound Name4-(cyclohexylmethoxy)-N-(2-piperazin-1-ylethyl)benzamide
PubChem CID119448595
Molecular FormulaC20H31N3O2
Molecular Weight345.49 g/mol
Exact Mass345.24
IUPAC Name4-(cyclohexylmethoxy)-N-(2-piperazin-1-ylethyl)benzamide
SMILESO=C(NCCN1CCNCC1)c1ccc(OCC2CCCCC2)cc1
InChIInChI=1S/C20H31N3O2/c24-20(22-12-15-23-13-10-21-11-14-23)18-6-8-19(9-7-18)25-16-17-4-2-1-3-5-17/h6-9,17,21H,1-5,10-16H2,(H,22,24)
InChIKeyLVMGHUJONLIYPG-UHFFFAOYSA-N
XLogP2.28
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.49
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-(cyclohexylmethoxy)-N-(2-piperazin-1-ylethyl)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

4-(cyclohexylmethoxy)-N-(2-pyrrolidin-3-ylethyl)benzamide
CID 119537467
carbonic acid;N-cyclohexyl-4-(piperidin-4-ylmethoxy)benzamide
CID 67802755
4-fluoro-N-(2-piperazin-1-ylethyl)benzamide
CID 10753244
4-[2-(diethylamino)ethoxy]-N-(2-piperazin-1-ylethyl)benzamide
CID 119448581
4-(cyclohexylmethoxy)-N-[(4-hydroxypyrrolidin-3-yl)methyl]benzamide
CID 120943780
[4-(cyclohexylmethoxy)phenyl]-(1,4-diazepan-1-yl)methanone;hydrochloride
CID 119418066
4-(2-methoxyethoxy)-N-(3-piperazin-1-ylpropyl)benzamide
CID 119392575
4-ethoxy-N-(2-piperidin-1-ylethyl)benzamide
CID 25237098
4-(2-amino-2-oxoethoxy)-N-(3-piperazin-1-ylpropyl)benzamide
CID 119391361
N-(3-piperazin-1-ylpropyl)-4-prop-2-enoxybenzamide;hydrochloride
CID 119393853
[[4-(cyclopentylmethoxy)benzoyl]amino]methanesulfinic acid
CID 174758918
4-(3,4-difluorophenoxy)-N-(2-piperazin-1-ylethyl)benzamide;hydrochloride
CID 119446997

Frequently Asked Questions

What is the IUPAC name of 4-(cyclohexylmethoxy)-N-(2-piperazin-1-ylethyl)benzamide?
The IUPAC name of 4-(cyclohexylmethoxy)-N-(2-piperazin-1-ylethyl)benzamide (CID 119448595) is 4-(cyclohexylmethoxy)-N-(2-piperazin-1-ylethyl)benzamide.
What is the SMILES notation for 4-(cyclohexylmethoxy)-N-(2-piperazin-1-ylethyl)benzamide?
The canonical SMILES for 4-(cyclohexylmethoxy)-N-(2-piperazin-1-ylethyl)benzamide is O=C(NCCN1CCNCC1)c1ccc(OCC2CCCCC2)cc1.
What is the InChIKey of 4-(cyclohexylmethoxy)-N-(2-piperazin-1-ylethyl)benzamide?
The InChIKey is LVMGHUJONLIYPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H31N3O2/c24-20(22-12-15-23-13-10-21-11-14-23)18-6-8-19(9-7-18)25-16-17-4-2-1-3-5-17/h6-9,17,21H,1-5,10-16H2,(H,22,24).
What are the key properties of 4-(cyclohexylmethoxy)-N-(2-piperazin-1-ylethyl)benzamide?
4-(cyclohexylmethoxy)-N-(2-piperazin-1-ylethyl)benzamide has a molecular weight of 345.49 g/mol, XLogP of 2.28, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclohexylmethoxy)-N-(2-piperazin-1-ylethyl)benzamide is sourced from PubChem (CID 119448595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).