3-(3,5-dimethylphenoxy)-N-methyl-N-piperidin-4-ylpropanamide

C17H26N2O2 — CID 119443487

IUPAC3-(3,5-dimethylphenoxy)-N-methyl-N-piperidin-4-ylpropanamide
SMILESCc1cc(C)cc(OCCC(=O)N(C)C2CCNCC2)c1
InChIInChI=1S/C17H26N2O2/c1-13-10-14(2)12-16(11-13)21-9-6-17(20)19(3)15-4-7-18-8-5-15/h10-12,15,18H,4-9H2,1-3H3
InChIKeyAYWPYNSPRXJECU-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.28
Rot. Bonds5

About 3-(3,5-dimethylphenoxy)-N-methyl-N-piperidin-4-ylpropanamide

3-(3,5-dimethylphenoxy)-N-methyl-N-piperidin-4-ylpropanamide (PubChem CID 119443487) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 3-(3,5-dimethylphenoxy)-N-methyl-N-piperidin-4-ylpropanamide.

Molecular Properties

Compound Name3-(3,5-dimethylphenoxy)-N-methyl-N-piperidin-4-ylpropanamide
PubChem CID119443487
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC Name3-(3,5-dimethylphenoxy)-N-methyl-N-piperidin-4-ylpropanamide
SMILESCc1cc(C)cc(OCCC(=O)N(C)C2CCNCC2)c1
InChIInChI=1S/C17H26N2O2/c1-13-10-14(2)12-16(11-13)21-9-6-17(20)19(3)15-4-7-18-8-5-15/h10-12,15,18H,4-9H2,1-3H3
InChIKeyAYWPYNSPRXJECU-UHFFFAOYSA-N
XLogP2.28
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-4-(3-methylphenoxy)-N-piperidin-4-ylbutanamide
CID 119442665
N-cyclopropyl-2-(3,5-dimethylphenoxy)-N-methylacetamide
CID 60749452
4-(4-chloro-3-methylphenoxy)-N-methyl-N-piperidin-4-ylbutanamide;hydrochloride
CID 119442076
3-(2,3-dimethylphenoxy)-N-methyl-N-piperidin-4-ylpropanamide;hydrochloride
CID 119444434
3-(2,5-dimethylphenoxy)-N-methyl-N-pyrrolidin-3-ylpropanamide;hydrochloride
CID 119551855
4-(3-acetylphenoxy)-N-methyl-N-piperidin-4-ylbutanamide;hydrochloride
CID 119443722
N,3,5-trimethyl-N-piperidin-4-ylbenzamide
CID 43602069
3-(3,5-dimethylphenoxy)-N,N-di(propan-2-yl)propanamide
CID 56530010
N-methyl-3-(2-phenylphenoxy)-N-piperidin-4-ylpropanamide
CID 119443416
3-(2-chlorophenoxy)-N-methyl-N-piperidin-4-ylpropanamide;hydrochloride
CID 119442168
N-methyl-4-(4-methylphenyl)-4-oxo-N-piperidin-4-ylbutanamide
CID 119442941
2-hydroxy-N-methyl-N-piperidin-4-ylacetamide
CID 89098845

Frequently Asked Questions

What is the IUPAC name of 3-(3,5-dimethylphenoxy)-N-methyl-N-piperidin-4-ylpropanamide?
The IUPAC name of 3-(3,5-dimethylphenoxy)-N-methyl-N-piperidin-4-ylpropanamide (CID 119443487) is 3-(3,5-dimethylphenoxy)-N-methyl-N-piperidin-4-ylpropanamide.
What is the SMILES notation for 3-(3,5-dimethylphenoxy)-N-methyl-N-piperidin-4-ylpropanamide?
The canonical SMILES for 3-(3,5-dimethylphenoxy)-N-methyl-N-piperidin-4-ylpropanamide is Cc1cc(C)cc(OCCC(=O)N(C)C2CCNCC2)c1.
What is the InChIKey of 3-(3,5-dimethylphenoxy)-N-methyl-N-piperidin-4-ylpropanamide?
The InChIKey is AYWPYNSPRXJECU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-13-10-14(2)12-16(11-13)21-9-6-17(20)19(3)15-4-7-18-8-5-15/h10-12,15,18H,4-9H2,1-3H3.
What are the key properties of 3-(3,5-dimethylphenoxy)-N-methyl-N-piperidin-4-ylpropanamide?
3-(3,5-dimethylphenoxy)-N-methyl-N-piperidin-4-ylpropanamide has a molecular weight of 290.41 g/mol, XLogP of 2.28, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,5-dimethylphenoxy)-N-methyl-N-piperidin-4-ylpropanamide is sourced from PubChem (CID 119443487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).