N-[1-(2-chlorophenyl)ethyl]-2-[methyl(piperidin-4-yl)amino]acetamide;hydrochloride

C16H25Cl2N3O — CID 119912445

IUPACN-[1-(2-chlorophenyl)ethyl]-2-[methyl(piperidin-4-yl)amino]acetamide;hydrochloride
SMILESCC(NC(=O)CN(C)C1CCNCC1)c1ccccc1Cl.Cl
InChIInChI=1S/C16H24ClN3O.ClH/c1-12(14-5-3-4-6-15(14)17)19-16(21)11-20(2)13-7-9-18-10-8-13;/h3-6,12-13,18H,7-11H2,1-2H3,(H,19,21);1H
InChIKeyPMIBPEJNVBVAED-UHFFFAOYSA-N
MW346.30 g/mol
LogP2.62
Rot. Bonds5

About N-[1-(2-chlorophenyl)ethyl]-2-[methyl(piperidin-4-yl)amino]acetamide;hydrochloride

N-[1-(2-chlorophenyl)ethyl]-2-[methyl(piperidin-4-yl)amino]acetamide;hydrochloride (PubChem CID 119912445) has the molecular formula C16H25Cl2N3O and a molecular weight of 346.30 g/mol. Its IUPAC name is N-[1-(2-chlorophenyl)ethyl]-2-[methyl(piperidin-4-yl)amino]acetamide;hydrochloride.

Molecular Properties

Compound NameN-[1-(2-chlorophenyl)ethyl]-2-[methyl(piperidin-4-yl)amino]acetamide;hydrochloride
PubChem CID119912445
Molecular FormulaC16H25Cl2N3O
Molecular Weight346.30 g/mol
Exact Mass345.14
IUPAC NameN-[1-(2-chlorophenyl)ethyl]-2-[methyl(piperidin-4-yl)amino]acetamide;hydrochloride
SMILESCC(NC(=O)CN(C)C1CCNCC1)c1ccccc1Cl.Cl
InChIInChI=1S/C16H24ClN3O.ClH/c1-12(14-5-3-4-6-15(14)17)19-16(21)11-20(2)13-7-9-18-10-8-13;/h3-6,12-13,18H,7-11H2,1-2H3,(H,19,21);1H
InChIKeyPMIBPEJNVBVAED-UHFFFAOYSA-N
XLogP2.62
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.30
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[1-(2-chlorophenyl)ethyl]-2-[methyl(piperidin-4-yl)amino]acetamide;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-[(1S)-1-(2-chlorophenyl)ethyl]-2-[methyl-(4-methylcyclohexyl)amino]acetamide
CID 39973443
N-[(1S)-1-(2-chlorophenyl)ethyl]-3-piperidin-4-ylpropanamide
CID 81379365
2-[azepan-4-yl(methyl)amino]-N-(1-phenylethyl)acetamide
CID 104979577
N-[(4-chlorophenyl)-phenylmethyl]-2-[methyl(piperidin-4-yl)amino]acetamide
CID 77090509
2-[[2-[1-(2-chlorophenyl)ethylamino]-2-oxoethyl]-methylamino]-N-cyclopropylacetamide
CID 84869554
2-[cyclopropyl(methyl)amino]-N-[1-(2,4-dichlorophenyl)ethyl]acetamide
CID 42956358
N-[(1S)-1-(3,5-difluorophenyl)ethyl]-2-[methyl(piperidin-4-yl)amino]acetamide
CID 99935705
2-[methyl(piperidin-4-yl)amino]-N-[(1S)-1-(3-methyl-2-pyridinyl)ethyl]acetamide
CID 125442607
N-[1-(2-chlorophenyl)ethyl]-2-[methyl(oxan-2-ylmethyl)amino]acetamide
CID 86825178
N-[1-(2-chlorophenyl)ethyl]-3-methylbutanamide
CID 78773468
2-[methyl(piperidin-4-yl)amino]-N-(2-methylpropyl)acetamide;hydrochloride
CID 119913617
2-amino-N-[1-(2-chlorophenyl)ethyl]acetamide;hydrochloride
CID 119268984

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-chlorophenyl)ethyl]-2-[methyl(piperidin-4-yl)amino]acetamide;hydrochloride?
The IUPAC name of N-[1-(2-chlorophenyl)ethyl]-2-[methyl(piperidin-4-yl)amino]acetamide;hydrochloride (CID 119912445) is N-[1-(2-chlorophenyl)ethyl]-2-[methyl(piperidin-4-yl)amino]acetamide;hydrochloride.
What is the SMILES notation for N-[1-(2-chlorophenyl)ethyl]-2-[methyl(piperidin-4-yl)amino]acetamide;hydrochloride?
The canonical SMILES for N-[1-(2-chlorophenyl)ethyl]-2-[methyl(piperidin-4-yl)amino]acetamide;hydrochloride is CC(NC(=O)CN(C)C1CCNCC1)c1ccccc1Cl.Cl.
What is the InChIKey of N-[1-(2-chlorophenyl)ethyl]-2-[methyl(piperidin-4-yl)amino]acetamide;hydrochloride?
The InChIKey is PMIBPEJNVBVAED-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24ClN3O.ClH/c1-12(14-5-3-4-6-15(14)17)19-16(21)11-20(2)13-7-9-18-10-8-13;/h3-6,12-13,18H,7-11H2,1-2H3,(H,19,21);1H.
What are the key properties of N-[1-(2-chlorophenyl)ethyl]-2-[methyl(piperidin-4-yl)amino]acetamide;hydrochloride?
N-[1-(2-chlorophenyl)ethyl]-2-[methyl(piperidin-4-yl)amino]acetamide;hydrochloride has a molecular weight of 346.30 g/mol, XLogP of 2.62, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-chlorophenyl)ethyl]-2-[methyl(piperidin-4-yl)amino]acetamide;hydrochloride is sourced from PubChem (CID 119912445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).