N-methyl-3-(2-phenylphenoxy)-N-piperidin-4-ylpropanamide

C21H26N2O2 — CID 119443416

IUPACN-methyl-3-(2-phenylphenoxy)-N-piperidin-4-ylpropanamide
SMILESCN(C(=O)CCOc1ccccc1-c1ccccc1)C1CCNCC1
InChIInChI=1S/C21H26N2O2/c1-23(18-11-14-22-15-12-18)21(24)13-16-25-20-10-6-5-9-19(20)17-7-3-2-4-8-17/h2-10,18,22H,11-16H2,1H3
InChIKeyHXIFDBGNKGBBBO-UHFFFAOYSA-N
MW338.45 g/mol
LogP3.33
Rot. Bonds6

About N-methyl-3-(2-phenylphenoxy)-N-piperidin-4-ylpropanamide

N-methyl-3-(2-phenylphenoxy)-N-piperidin-4-ylpropanamide (PubChem CID 119443416) has the molecular formula C21H26N2O2 and a molecular weight of 338.45 g/mol. Its IUPAC name is N-methyl-3-(2-phenylphenoxy)-N-piperidin-4-ylpropanamide.

Molecular Properties

Compound NameN-methyl-3-(2-phenylphenoxy)-N-piperidin-4-ylpropanamide
PubChem CID119443416
Molecular FormulaC21H26N2O2
Molecular Weight338.45 g/mol
Exact Mass338.20
IUPAC NameN-methyl-3-(2-phenylphenoxy)-N-piperidin-4-ylpropanamide
SMILESCN(C(=O)CCOc1ccccc1-c1ccccc1)C1CCNCC1
InChIInChI=1S/C21H26N2O2/c1-23(18-11-14-22-15-12-18)21(24)13-16-25-20-10-6-5-9-19(20)17-7-3-2-4-8-17/h2-10,18,22H,11-16H2,1H3
InChIKeyHXIFDBGNKGBBBO-UHFFFAOYSA-N
XLogP3.33
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.45
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(2-phenylphenoxy)-N-piperidin-4-yl-N-propylpropanamide
CID 119825238
3-(2-chlorophenoxy)-N-methyl-N-piperidin-4-ylpropanamide;hydrochloride
CID 119442168
3-(2,3-dimethylphenoxy)-N-methyl-N-piperidin-4-ylpropanamide;hydrochloride
CID 119444434
N-methyl-4-oxo-4-(4-phenylphenyl)-N-piperidin-4-ylbutanamide
CID 119443079
4-(2-ethoxyphenoxy)-N-methyl-N-pyrrolidin-3-ylbutanamide;hydrochloride
CID 119554526
2-(2-ethylphenoxy)-N-methyl-N-piperidin-4-ylacetamide
CID 119441590
N-methyl-2-(4-phenylphenyl)-N-piperidin-4-ylacetamide;hydrochloride
CID 119441133
3-(3,5-dimethylphenoxy)-N-methyl-N-piperidin-4-ylpropanamide
CID 119443487
N-(azepan-4-yl)-N-methyl-3-phenylpropanamide
CID 104974503
3-(2-chloro-4-fluorophenoxy)-N-methyl-N-[(3R)-pyrrolidin-3-yl]propanamide
CID 124613703
2-hydroxy-N-methyl-N-piperidin-4-ylacetamide
CID 89098845
1,1-dimethyl-3-[(2-phenylphenyl)methyl]-3-[(3S)-pyrrolidin-3-yl]urea
CID 44578375

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-(2-phenylphenoxy)-N-piperidin-4-ylpropanamide?
The IUPAC name of N-methyl-3-(2-phenylphenoxy)-N-piperidin-4-ylpropanamide (CID 119443416) is N-methyl-3-(2-phenylphenoxy)-N-piperidin-4-ylpropanamide.
What is the SMILES notation for N-methyl-3-(2-phenylphenoxy)-N-piperidin-4-ylpropanamide?
The canonical SMILES for N-methyl-3-(2-phenylphenoxy)-N-piperidin-4-ylpropanamide is CN(C(=O)CCOc1ccccc1-c1ccccc1)C1CCNCC1.
What is the InChIKey of N-methyl-3-(2-phenylphenoxy)-N-piperidin-4-ylpropanamide?
The InChIKey is HXIFDBGNKGBBBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N2O2/c1-23(18-11-14-22-15-12-18)21(24)13-16-25-20-10-6-5-9-19(20)17-7-3-2-4-8-17/h2-10,18,22H,11-16H2,1H3.
What are the key properties of N-methyl-3-(2-phenylphenoxy)-N-piperidin-4-ylpropanamide?
N-methyl-3-(2-phenylphenoxy)-N-piperidin-4-ylpropanamide has a molecular weight of 338.45 g/mol, XLogP of 3.33, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-(2-phenylphenoxy)-N-piperidin-4-ylpropanamide is sourced from PubChem (CID 119443416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).