N-benzyl-N-(2-methoxyethyl)-3-piperidin-3-ylbutanamide;hydrochloride

C19H31ClN2O2 — CID 119681552

IUPACN-benzyl-N-(2-methoxyethyl)-3-piperidin-3-ylbutanamide;hydrochloride
SMILESCOCCN(Cc1ccccc1)C(=O)CC(C)C1CCCNC1.Cl
InChIInChI=1S/C19H30N2O2.ClH/c1-16(18-9-6-10-20-14-18)13-19(22)21(11-12-23-2)15-17-7-4-3-5-8-17;/h3-5,7-8,16,18,20H,6,9-15H2,1-2H3;1H
InChIKeyZTORGXWLJUTBQD-UHFFFAOYSA-N
MW354.92 g/mol
LogP3.11
Rot. Bonds8

About N-benzyl-N-(2-methoxyethyl)-3-piperidin-3-ylbutanamide;hydrochloride

N-benzyl-N-(2-methoxyethyl)-3-piperidin-3-ylbutanamide;hydrochloride (PubChem CID 119681552) has the molecular formula C19H31ClN2O2 and a molecular weight of 354.92 g/mol. Its IUPAC name is N-benzyl-N-(2-methoxyethyl)-3-piperidin-3-ylbutanamide;hydrochloride.

Molecular Properties

Compound NameN-benzyl-N-(2-methoxyethyl)-3-piperidin-3-ylbutanamide;hydrochloride
PubChem CID119681552
Molecular FormulaC19H31ClN2O2
Molecular Weight354.92 g/mol
Exact Mass354.21
IUPAC NameN-benzyl-N-(2-methoxyethyl)-3-piperidin-3-ylbutanamide;hydrochloride
SMILESCOCCN(Cc1ccccc1)C(=O)CC(C)C1CCCNC1.Cl
InChIInChI=1S/C19H30N2O2.ClH/c1-16(18-9-6-10-20-14-18)13-19(22)21(11-12-23-2)15-17-7-4-3-5-8-17;/h3-5,7-8,16,18,20H,6,9-15H2,1-2H3;1H
InChIKeyZTORGXWLJUTBQD-UHFFFAOYSA-N
XLogP3.11
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.92
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-methoxyethyl)-N-(3-phenylpropyl)-3-piperidin-3-ylbutanamide
CID 119756066
N-[(2-chloro-4-fluorophenyl)methyl]-N-(2-methoxyethyl)-3-piperidin-3-ylbutanamide;hydrochloride
CID 119778587
N-methyl-N-(2-phenylmethoxyethyl)-3-piperidin-3-ylbutanamide;hydrochloride
CID 119821443
N-methyl-N-(2-phenylmethoxyethyl)-3-piperidin-3-ylbutanamide
CID 119821444
N-cyclopropyl-N-(2-methoxyethyl)-3-piperidin-3-ylbutanamide
CID 81043582
N-methyl-N-(3-phenoxypropyl)-3-piperidin-3-ylbutanamide;hydrochloride
CID 119731938
N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-3-piperidin-3-ylbutanamide;hydrochloride
CID 119692017
N-benzyl-N-(2-methoxyethyl)pyrrolidine-3-carboxamide
CID 63007100
N-[2-[benzyl(methyl)amino]-2-oxoethyl]-3-piperidin-3-ylbutanamide
CID 119719387
3-piperidin-3-yl-N,N-dipropylbutanamide
CID 81043811
N-(2-methoxyethyl)-N-(3-phenylpropyl)piperidine-3-carboxamide
CID 119307596
N-benzyl-N-(cyclobutylmethyl)-3-piperidin-4-ylbutanamide;hydrochloride
CID 119752557

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-(2-methoxyethyl)-3-piperidin-3-ylbutanamide;hydrochloride?
The IUPAC name of N-benzyl-N-(2-methoxyethyl)-3-piperidin-3-ylbutanamide;hydrochloride (CID 119681552) is N-benzyl-N-(2-methoxyethyl)-3-piperidin-3-ylbutanamide;hydrochloride.
What is the SMILES notation for N-benzyl-N-(2-methoxyethyl)-3-piperidin-3-ylbutanamide;hydrochloride?
The canonical SMILES for N-benzyl-N-(2-methoxyethyl)-3-piperidin-3-ylbutanamide;hydrochloride is COCCN(Cc1ccccc1)C(=O)CC(C)C1CCCNC1.Cl.
What is the InChIKey of N-benzyl-N-(2-methoxyethyl)-3-piperidin-3-ylbutanamide;hydrochloride?
The InChIKey is ZTORGXWLJUTBQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2O2.ClH/c1-16(18-9-6-10-20-14-18)13-19(22)21(11-12-23-2)15-17-7-4-3-5-8-17;/h3-5,7-8,16,18,20H,6,9-15H2,1-2H3;1H.
What are the key properties of N-benzyl-N-(2-methoxyethyl)-3-piperidin-3-ylbutanamide;hydrochloride?
N-benzyl-N-(2-methoxyethyl)-3-piperidin-3-ylbutanamide;hydrochloride has a molecular weight of 354.92 g/mol, XLogP of 3.11, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-(2-methoxyethyl)-3-piperidin-3-ylbutanamide;hydrochloride is sourced from PubChem (CID 119681552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).