N-benzyl-N-(cyclobutylmethyl)-3-piperidin-4-ylbutanamide;hydrochloride

C21H33ClN2O — CID 119752557

IUPACN-benzyl-N-(cyclobutylmethyl)-3-piperidin-4-ylbutanamide;hydrochloride
SMILESCC(CC(=O)N(Cc1ccccc1)CC1CCC1)C1CCNCC1.Cl
InChIInChI=1S/C21H32N2O.ClH/c1-17(20-10-12-22-13-11-20)14-21(24)23(16-19-8-5-9-19)15-18-6-3-2-4-7-18;/h2-4,6-7,17,19-20,22H,5,8-16H2,1H3;1H
InChIKeyBFGXJPDTFVTHEG-UHFFFAOYSA-N
MW364.96 g/mol
LogP4.26
Rot. Bonds7

About N-benzyl-N-(cyclobutylmethyl)-3-piperidin-4-ylbutanamide;hydrochloride

N-benzyl-N-(cyclobutylmethyl)-3-piperidin-4-ylbutanamide;hydrochloride (PubChem CID 119752557) has the molecular formula C21H33ClN2O and a molecular weight of 364.96 g/mol. Its IUPAC name is N-benzyl-N-(cyclobutylmethyl)-3-piperidin-4-ylbutanamide;hydrochloride.

Molecular Properties

Compound NameN-benzyl-N-(cyclobutylmethyl)-3-piperidin-4-ylbutanamide;hydrochloride
PubChem CID119752557
Molecular FormulaC21H33ClN2O
Molecular Weight364.96 g/mol
Exact Mass364.23
IUPAC NameN-benzyl-N-(cyclobutylmethyl)-3-piperidin-4-ylbutanamide;hydrochloride
SMILESCC(CC(=O)N(Cc1ccccc1)CC1CCC1)C1CCNCC1.Cl
InChIInChI=1S/C21H32N2O.ClH/c1-17(20-10-12-22-13-11-20)14-21(24)23(16-19-8-5-9-19)15-18-6-3-2-4-7-18;/h2-4,6-7,17,19-20,22H,5,8-16H2,1H3;1H
InChIKeyBFGXJPDTFVTHEG-UHFFFAOYSA-N
XLogP4.26
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.96
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-benzyl-N-(cyclobutylmethyl)-3-piperidin-4-ylbutanamide;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-benzyl-N-(oxolan-2-ylmethyl)-3-piperidin-4-ylbutanamide
CID 119747376
N-(2-amino-2-oxoethyl)-N-benzyl-3-piperidin-4-ylbutanamide
CID 119783037
N-(cyclobutylmethyl)-N-(1-phenylethyl)-3-piperidin-4-ylbutanamide
CID 119799552
1-[4-[[benzyl(methyl)amino]methyl]piperidin-1-yl]-3-piperidin-4-ylbutan-1-one;dihydrochloride
CID 119875260
N-(cyclopropylmethyl)-N-phenyl-3-piperidin-4-ylbutanamide;hydrochloride
CID 119810163
N-cyclopentyl-N-(2-phenylethyl)-3-piperidin-4-ylbutanamide;hydrochloride
CID 119771595
N-benzyl-N-(2-hydroxy-2-thiophen-2-ylethyl)-3-piperidin-4-ylbutanamide
CID 119816685
N-(cyclohexylmethyl)-3-piperidin-4-yl-N-prop-2-enylbutanamide;hydrochloride
CID 119784515
N-benzyl-N-(2-hydroxy-2-thiophen-3-ylethyl)-3-piperidin-4-ylbutanamide
CID 119821292
(2S)-2-amino-N-benzyl-N-(cyclobutylmethyl)propanamide;hydrochloride
CID 119305505
N-benzyl-2-chloro-N-(cyclobutylmethyl)acetamide
CID 166403801
N-benzyl-N-(2-methoxyethyl)-3-piperidin-3-ylbutanamide;hydrochloride
CID 119681552

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-(cyclobutylmethyl)-3-piperidin-4-ylbutanamide;hydrochloride?
The IUPAC name of N-benzyl-N-(cyclobutylmethyl)-3-piperidin-4-ylbutanamide;hydrochloride (CID 119752557) is N-benzyl-N-(cyclobutylmethyl)-3-piperidin-4-ylbutanamide;hydrochloride.
What is the SMILES notation for N-benzyl-N-(cyclobutylmethyl)-3-piperidin-4-ylbutanamide;hydrochloride?
The canonical SMILES for N-benzyl-N-(cyclobutylmethyl)-3-piperidin-4-ylbutanamide;hydrochloride is CC(CC(=O)N(Cc1ccccc1)CC1CCC1)C1CCNCC1.Cl.
What is the InChIKey of N-benzyl-N-(cyclobutylmethyl)-3-piperidin-4-ylbutanamide;hydrochloride?
The InChIKey is BFGXJPDTFVTHEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H32N2O.ClH/c1-17(20-10-12-22-13-11-20)14-21(24)23(16-19-8-5-9-19)15-18-6-3-2-4-7-18;/h2-4,6-7,17,19-20,22H,5,8-16H2,1H3;1H.
What are the key properties of N-benzyl-N-(cyclobutylmethyl)-3-piperidin-4-ylbutanamide;hydrochloride?
N-benzyl-N-(cyclobutylmethyl)-3-piperidin-4-ylbutanamide;hydrochloride has a molecular weight of 364.96 g/mol, XLogP of 4.26, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-(cyclobutylmethyl)-3-piperidin-4-ylbutanamide;hydrochloride is sourced from PubChem (CID 119752557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).