N-[2-(2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)ethyl]-2-(oxan-2-yl)acetamide

C22H34N2O3 — CID 110622426

IUPACN-[2-(2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)ethyl]-2-(oxan-2-yl)acetamide
SMILESCOc1ccccc1C(CNC(=O)CC1CCCCO1)N1CCC(C)CC1
InChIInChI=1S/C22H34N2O3/c1-17-10-12-24(13-11-17)20(19-8-3-4-9-21(19)26-2)16-23-22(25)15-18-7-5-6-14-27-18/h3-4,8-9,17-18,20H,5-7,10-16H2,1-2H3,(H,23,25)
InChIKeySINAZVGDQYFQHE-UHFFFAOYSA-N
MW374.53 g/mol
LogP3.54
Rot. Bonds7

About N-[2-(2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)ethyl]-2-(oxan-2-yl)acetamide

N-[2-(2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)ethyl]-2-(oxan-2-yl)acetamide (PubChem CID 110622426) has the molecular formula C22H34N2O3 and a molecular weight of 374.53 g/mol. Its IUPAC name is N-[2-(2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)ethyl]-2-(oxan-2-yl)acetamide.

Molecular Properties

Compound NameN-[2-(2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)ethyl]-2-(oxan-2-yl)acetamide
PubChem CID110622426
Molecular FormulaC22H34N2O3
Molecular Weight374.53 g/mol
Exact Mass374.26
IUPAC NameN-[2-(2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)ethyl]-2-(oxan-2-yl)acetamide
SMILESCOc1ccccc1C(CNC(=O)CC1CCCCO1)N1CCC(C)CC1
InChIInChI=1S/C22H34N2O3/c1-17-10-12-24(13-11-17)20(19-8-3-4-9-21(19)26-2)16-23-22(25)15-18-7-5-6-14-27-18/h3-4,8-9,17-18,20H,5-7,10-16H2,1-2H3,(H,23,25)
InChIKeySINAZVGDQYFQHE-UHFFFAOYSA-N
XLogP3.54
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.53
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(4-methoxyphenyl)-2-(4-methylpiperazin-1-yl)ethyl]-2-(oxan-2-yl)acetamide
CID 110622301
N-[(2-methoxyphenyl)methyl]-2-(oxan-2-yl)acetamide
CID 110410171
2-fluoro-N-[2-(2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)ethyl]benzamide
CID 112504610
N-[2-(2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)ethyl]-3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxamide
CID 110622415
N-[2-(2-methoxyphenyl)-2-morpholin-4-ylethyl]oxolane-2-carboxamide
CID 112504090
N-[(2S)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]cyclobutanecarboxamide
CID 30522180
N-[2-(2-methoxyphenyl)-2-piperidin-1-ylethyl]-2-(methylamino)acetamide
CID 120703941
N-[2-[[(2S)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]amino]-2-oxoethyl]benzamide
CID 34937128
N-[2-(2-methoxyphenyl)-2-morpholin-4-ylethyl]pentanamide
CID 112504087
2-(2-methoxyphenyl)-N-[2-(4-methylpiperidin-1-yl)-2-thiophen-2-ylethyl]acetamide
CID 43006350
1-[2-(2-methoxyphenyl)-2-piperidin-1-ylethyl]-3-(oxan-4-yl)urea
CID 110622092
2-(2-methoxyethylamino)-N-[2-(2-methoxyphenyl)-2-piperidin-1-ylethyl]acetamide;dihydrochloride
CID 119849351

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)ethyl]-2-(oxan-2-yl)acetamide?
The IUPAC name of N-[2-(2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)ethyl]-2-(oxan-2-yl)acetamide (CID 110622426) is N-[2-(2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)ethyl]-2-(oxan-2-yl)acetamide.
What is the SMILES notation for N-[2-(2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)ethyl]-2-(oxan-2-yl)acetamide?
The canonical SMILES for N-[2-(2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)ethyl]-2-(oxan-2-yl)acetamide is COc1ccccc1C(CNC(=O)CC1CCCCO1)N1CCC(C)CC1.
What is the InChIKey of N-[2-(2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)ethyl]-2-(oxan-2-yl)acetamide?
The InChIKey is SINAZVGDQYFQHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H34N2O3/c1-17-10-12-24(13-11-17)20(19-8-3-4-9-21(19)26-2)16-23-22(25)15-18-7-5-6-14-27-18/h3-4,8-9,17-18,20H,5-7,10-16H2,1-2H3,(H,23,25).
What are the key properties of N-[2-(2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)ethyl]-2-(oxan-2-yl)acetamide?
N-[2-(2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)ethyl]-2-(oxan-2-yl)acetamide has a molecular weight of 374.53 g/mol, XLogP of 3.54, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)ethyl]-2-(oxan-2-yl)acetamide is sourced from PubChem (CID 110622426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).