N-methyl-2-(4-methylphenoxy)-N-piperidin-4-ylpropanamide;hydrochloride

C16H25ClN2O2 — CID 119442967

IUPACN-methyl-2-(4-methylphenoxy)-N-piperidin-4-ylpropanamide;hydrochloride
SMILESCc1ccc(OC(C)C(=O)N(C)C2CCNCC2)cc1.Cl
InChIInChI=1S/C16H24N2O2.ClH/c1-12-4-6-15(7-5-12)20-13(2)16(19)18(3)14-8-10-17-11-9-14;/h4-7,13-14,17H,8-11H2,1-3H3;1H
InChIKeyFZDHKWXAKOGOTL-UHFFFAOYSA-N
MW312.84 g/mol
LogP2.39
Rot. Bonds4

About N-methyl-2-(4-methylphenoxy)-N-piperidin-4-ylpropanamide;hydrochloride

N-methyl-2-(4-methylphenoxy)-N-piperidin-4-ylpropanamide;hydrochloride (PubChem CID 119442967) has the molecular formula C16H25ClN2O2 and a molecular weight of 312.84 g/mol. Its IUPAC name is N-methyl-2-(4-methylphenoxy)-N-piperidin-4-ylpropanamide;hydrochloride.

Molecular Properties

Compound NameN-methyl-2-(4-methylphenoxy)-N-piperidin-4-ylpropanamide;hydrochloride
PubChem CID119442967
Molecular FormulaC16H25ClN2O2
Molecular Weight312.84 g/mol
Exact Mass312.16
IUPAC NameN-methyl-2-(4-methylphenoxy)-N-piperidin-4-ylpropanamide;hydrochloride
SMILESCc1ccc(OC(C)C(=O)N(C)C2CCNCC2)cc1.Cl
InChIInChI=1S/C16H24N2O2.ClH/c1-12-4-6-15(7-5-12)20-13(2)16(19)18(3)14-8-10-17-11-9-14;/h4-7,13-14,17H,8-11H2,1-3H3;1H
InChIKeyFZDHKWXAKOGOTL-UHFFFAOYSA-N
XLogP2.39
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.84
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-tert-butylphenoxy)-N-methyl-N-piperidin-4-ylpropanamide
CID 119441988
N-methyl-2-(4-phenylphenoxy)-N-pyrrolidin-3-ylpropanamide;hydrochloride
CID 119554555
N-methyl-2-(4-phenylphenoxy)-N-pyrrolidin-3-ylpropanamide
CID 119554556
(2S)-2-(2-bromo-4-fluorophenoxy)-N-methyl-N-piperidin-4-ylpropanamide
CID 124571160
4-[1-[cyclohexyl(methyl)amino]-1-oxopropan-2-yl]oxybenzamide
CID 51142647
4-butan-2-yloxy-N-methyl-N-piperidin-4-ylbenzamide;hydrochloride
CID 119443676
2-(4-methylsulfanylphenoxy)-N-piperidin-4-yl-N-propylpropanamide;hydrochloride
CID 119823825
2-ethoxy-N-methyl-N-piperidin-4-ylpropanamide
CID 119444012
(2S)-N-cyclopentyl-N-methyl-2-naphthalen-2-yloxypropanamide
CID 38015885
2-(4-methoxyphenoxy)-N-propyl-N-pyrrolidin-3-ylpropanamide;hydrochloride
CID 119532521
2-(2,4-dichlorophenoxy)-N-methyl-N-pyrrolidin-3-ylpropanamide;hydrochloride
CID 119550666
N-cyclobutyl-N-(3-hydroxypropyl)-2-(4-methylphenoxy)propanamide
CID 102866166

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(4-methylphenoxy)-N-piperidin-4-ylpropanamide;hydrochloride?
The IUPAC name of N-methyl-2-(4-methylphenoxy)-N-piperidin-4-ylpropanamide;hydrochloride (CID 119442967) is N-methyl-2-(4-methylphenoxy)-N-piperidin-4-ylpropanamide;hydrochloride.
What is the SMILES notation for N-methyl-2-(4-methylphenoxy)-N-piperidin-4-ylpropanamide;hydrochloride?
The canonical SMILES for N-methyl-2-(4-methylphenoxy)-N-piperidin-4-ylpropanamide;hydrochloride is Cc1ccc(OC(C)C(=O)N(C)C2CCNCC2)cc1.Cl.
What is the InChIKey of N-methyl-2-(4-methylphenoxy)-N-piperidin-4-ylpropanamide;hydrochloride?
The InChIKey is FZDHKWXAKOGOTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2.ClH/c1-12-4-6-15(7-5-12)20-13(2)16(19)18(3)14-8-10-17-11-9-14;/h4-7,13-14,17H,8-11H2,1-3H3;1H.
What are the key properties of N-methyl-2-(4-methylphenoxy)-N-piperidin-4-ylpropanamide;hydrochloride?
N-methyl-2-(4-methylphenoxy)-N-piperidin-4-ylpropanamide;hydrochloride has a molecular weight of 312.84 g/mol, XLogP of 2.39, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(4-methylphenoxy)-N-piperidin-4-ylpropanamide;hydrochloride is sourced from PubChem (CID 119442967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).