2-(4-ethylphenyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2-methylpropanamide

C20H32N2O2 — CID 120891055

IUPAC2-(4-ethylphenyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2-methylpropanamide
SMILESCCc1ccc(C(C)(C)C(=O)NCC2(COC)CCNCC2)cc1
InChIInChI=1S/C20H32N2O2/c1-5-16-6-8-17(9-7-16)19(2,3)18(23)22-14-20(15-24-4)10-12-21-13-11-20/h6-9,21H,5,10-15H2,1-4H3,(H,22,23)
InChIKeySXXXWFSBMPYYNY-UHFFFAOYSA-N
MW332.49 g/mol
LogP2.66
Rot. Bonds7

About 2-(4-ethylphenyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2-methylpropanamide

2-(4-ethylphenyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2-methylpropanamide (PubChem CID 120891055) has the molecular formula C20H32N2O2 and a molecular weight of 332.49 g/mol. Its IUPAC name is 2-(4-ethylphenyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2-methylpropanamide.

Molecular Properties

Compound Name2-(4-ethylphenyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2-methylpropanamide
PubChem CID120891055
Molecular FormulaC20H32N2O2
Molecular Weight332.49 g/mol
Exact Mass332.25
IUPAC Name2-(4-ethylphenyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2-methylpropanamide
SMILESCCc1ccc(C(C)(C)C(=O)NCC2(COC)CCNCC2)cc1
InChIInChI=1S/C20H32N2O2/c1-5-16-6-8-17(9-7-16)19(2,3)18(23)22-14-20(15-24-4)10-12-21-13-11-20/h6-9,21H,5,10-15H2,1-4H3,(H,22,23)
InChIKeySXXXWFSBMPYYNY-UHFFFAOYSA-N
XLogP2.66
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.49
LogP ≤ 52.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(4-ethylphenyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-4-oxobutanamide;hydrochloride
CID 120891250
2-(4-chlorophenyl)-2-ethyl-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]butanamide;hydrochloride
CID 120890396
2,2-difluoro-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2-phenylacetamide
CID 120888865
N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-3-methyl-3-phenylbutanamide
CID 120888204
N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-4-(trifluoromethyl)benzamide;hydrochloride
CID 120888968
3-(3-chlorophenyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2,2-dimethylpropanamide
CID 120888763
4-fluoro-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]benzamide
CID 120890009
4-(acetamidomethyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]benzamide;hydrochloride
CID 120888912
N-[2-[[4-(methoxymethyl)piperidin-4-yl]methylamino]-2-oxoethyl]-2,2-dimethylpropanamide
CID 120891836
1-(4-ethylphenyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-5-oxopyrrolidine-3-carboxamide
CID 120888949
N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2-(4-nitrophenyl)acetamide
CID 120888033
N-[2-[[4-(methoxymethyl)piperidin-4-yl]methylamino]-2-oxoethyl]-2,2-dimethylpropanamide;hydrochloride
CID 120891835

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethylphenyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2-methylpropanamide?
The IUPAC name of 2-(4-ethylphenyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2-methylpropanamide (CID 120891055) is 2-(4-ethylphenyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2-methylpropanamide.
What is the SMILES notation for 2-(4-ethylphenyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2-methylpropanamide?
The canonical SMILES for 2-(4-ethylphenyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2-methylpropanamide is CCc1ccc(C(C)(C)C(=O)NCC2(COC)CCNCC2)cc1.
What is the InChIKey of 2-(4-ethylphenyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2-methylpropanamide?
The InChIKey is SXXXWFSBMPYYNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H32N2O2/c1-5-16-6-8-17(9-7-16)19(2,3)18(23)22-14-20(15-24-4)10-12-21-13-11-20/h6-9,21H,5,10-15H2,1-4H3,(H,22,23).
What are the key properties of 2-(4-ethylphenyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2-methylpropanamide?
2-(4-ethylphenyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2-methylpropanamide has a molecular weight of 332.49 g/mol, XLogP of 2.66, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethylphenyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2-methylpropanamide is sourced from PubChem (CID 120891055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).