2-[furan-2-ylmethyl-[2-[3-(2-piperidin-1-ylethoxy)phenyl]ethyl]amino]-N-methylacetamide;hydrochloride

C23H34ClN3O3 — CID 66590485

IUPAC2-[furan-2-ylmethyl-[2-[3-(2-piperidin-1-ylethoxy)phenyl]ethyl]amino]-N-methylacetamide;hydrochloride
SMILESCNC(=O)CN(CCc1cccc(OCCN2CCCCC2)c1)Cc1ccco1.Cl
InChIInChI=1S/C23H33N3O3.ClH/c1-24-23(27)19-26(18-22-9-6-15-28-22)13-10-20-7-5-8-21(17-20)29-16-14-25-11-3-2-4-12-25;/h5-9,15,17H,2-4,10-14,16,18-19H2,1H3,(H,24,27);1H
InChIKeySWUNGNXBPKLMAF-UHFFFAOYSA-N
MW436.00 g/mol
LogP3.36
Rot. Bonds11

About 2-[furan-2-ylmethyl-[2-[3-(2-piperidin-1-ylethoxy)phenyl]ethyl]amino]-N-methylacetamide;hydrochloride

2-[furan-2-ylmethyl-[2-[3-(2-piperidin-1-ylethoxy)phenyl]ethyl]amino]-N-methylacetamide;hydrochloride (PubChem CID 66590485) has the molecular formula C23H34ClN3O3 and a molecular weight of 436.00 g/mol. Its IUPAC name is 2-[furan-2-ylmethyl-[2-[3-(2-piperidin-1-ylethoxy)phenyl]ethyl]amino]-N-methylacetamide;hydrochloride.

Molecular Properties

Compound Name2-[furan-2-ylmethyl-[2-[3-(2-piperidin-1-ylethoxy)phenyl]ethyl]amino]-N-methylacetamide;hydrochloride
PubChem CID66590485
Molecular FormulaC23H34ClN3O3
Molecular Weight436.00 g/mol
Exact Mass435.23
IUPAC Name2-[furan-2-ylmethyl-[2-[3-(2-piperidin-1-ylethoxy)phenyl]ethyl]amino]-N-methylacetamide;hydrochloride
SMILESCNC(=O)CN(CCc1cccc(OCCN2CCCCC2)c1)Cc1ccco1.Cl
InChIInChI=1S/C23H33N3O3.ClH/c1-24-23(27)19-26(18-22-9-6-15-28-22)13-10-20-7-5-8-21(17-20)29-16-14-25-11-3-2-4-12-25;/h5-9,15,17H,2-4,10-14,16,18-19H2,1H3,(H,24,27);1H
InChIKeySWUNGNXBPKLMAF-UHFFFAOYSA-N
XLogP3.36
TPSA57.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500436.00
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-[furan-2-ylmethyl-[2-[3-(2-piperidin-1-ylethoxy)phenyl]ethyl]amino]-N-methylacetamide;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

2-[furan-2-ylmethyl-[2-(3-phenylmethoxyphenyl)ethyl]amino]-N-methylacetamide
CID 59596821
2-[2-[3-[(3-fluorophenyl)methoxy]phenyl]ethyl-(furan-2-ylmethyl)amino]-N-(2-methoxyethyl)acetamide;hydrochloride
CID 66591030
2-[2-[3-[2-[(dimethylamino)methyl]phenyl]phenyl]ethyl-(furan-2-ylmethyl)amino]-N-methylacetamide;hydrochloride
CID 66591426
N-[2-(dimethylamino)ethyl]-2-[2-[3-[(3-fluorophenyl)methoxy]phenyl]ethyl-(furan-2-ylmethyl)amino]acetamide;dihydrochloride
CID 66591504
N-methyl-2-[3-(2-pyrrolidin-1-ylethoxy)phenyl]ethanamine
CID 170714078
N-ethyl-N-[3-[3-(3-piperidin-1-ylpropoxy)phenyl]propyl]acetamide
CID 142864877
2-[2-[3-[(3-fluorophenyl)methoxy]phenyl]ethyl-(furan-2-ylmethyl)amino]-N-(1H-pyrazol-5-yl)acetamide
CID 66591114
1-[4-(3-ethylphenoxy)butyl]piperidine;oxalic acid
CID 2922693
2-[[3-[(2R)-3-(azepan-1-yl)-2-hydroxypropoxy]phenyl]methyl-methylamino]-N-methylacetamide
CID 97273675
N-(furan-2-ylmethyl)-N-methyl-2-[4-(2-phenoxyethyl)piperazin-1-yl]acetamide
CID 78792851
2-[[3-(2-piperidin-1-ylethoxy)phenyl]methylcarbamoyl]cyclohexane-1-carboxylic acid
CID 22685902
3-[2-(azocan-1-yl)ethoxy]benzoic acid
CID 43532593

Frequently Asked Questions

What is the IUPAC name of 2-[furan-2-ylmethyl-[2-[3-(2-piperidin-1-ylethoxy)phenyl]ethyl]amino]-N-methylacetamide;hydrochloride?
The IUPAC name of 2-[furan-2-ylmethyl-[2-[3-(2-piperidin-1-ylethoxy)phenyl]ethyl]amino]-N-methylacetamide;hydrochloride (CID 66590485) is 2-[furan-2-ylmethyl-[2-[3-(2-piperidin-1-ylethoxy)phenyl]ethyl]amino]-N-methylacetamide;hydrochloride.
What is the SMILES notation for 2-[furan-2-ylmethyl-[2-[3-(2-piperidin-1-ylethoxy)phenyl]ethyl]amino]-N-methylacetamide;hydrochloride?
The canonical SMILES for 2-[furan-2-ylmethyl-[2-[3-(2-piperidin-1-ylethoxy)phenyl]ethyl]amino]-N-methylacetamide;hydrochloride is CNC(=O)CN(CCc1cccc(OCCN2CCCCC2)c1)Cc1ccco1.Cl.
What is the InChIKey of 2-[furan-2-ylmethyl-[2-[3-(2-piperidin-1-ylethoxy)phenyl]ethyl]amino]-N-methylacetamide;hydrochloride?
The InChIKey is SWUNGNXBPKLMAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H33N3O3.ClH/c1-24-23(27)19-26(18-22-9-6-15-28-22)13-10-20-7-5-8-21(17-20)29-16-14-25-11-3-2-4-12-25;/h5-9,15,17H,2-4,10-14,16,18-19H2,1H3,(H,24,27);1H.
What are the key properties of 2-[furan-2-ylmethyl-[2-[3-(2-piperidin-1-ylethoxy)phenyl]ethyl]amino]-N-methylacetamide;hydrochloride?
2-[furan-2-ylmethyl-[2-[3-(2-piperidin-1-ylethoxy)phenyl]ethyl]amino]-N-methylacetamide;hydrochloride has a molecular weight of 436.00 g/mol, XLogP of 3.36, 11 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[furan-2-ylmethyl-[2-[3-(2-piperidin-1-ylethoxy)phenyl]ethyl]amino]-N-methylacetamide;hydrochloride is sourced from PubChem (CID 66590485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).