N-(3-methoxyphenyl)-2-[3-methyl-4-(methylamino)piperidin-1-yl]acetamide

C16H25N3O2 — CID 114499122

IUPACN-(3-methoxyphenyl)-2-[3-methyl-4-(methylamino)piperidin-1-yl]acetamide
SMILESCNC1CCN(CC(=O)Nc2cccc(OC)c2)CC1C
InChIInChI=1S/C16H25N3O2/c1-12-10-19(8-7-15(12)17-2)11-16(20)18-13-5-4-6-14(9-13)21-3/h4-6,9,12,15,17H,7-8,10-11H2,1-3H3,(H,18,20)
InChIKeyQIOLWISKYQZWHG-UHFFFAOYSA-N
MW291.39 g/mol
LogP1.56
Rot. Bonds5

About N-(3-methoxyphenyl)-2-[3-methyl-4-(methylamino)piperidin-1-yl]acetamide

N-(3-methoxyphenyl)-2-[3-methyl-4-(methylamino)piperidin-1-yl]acetamide (PubChem CID 114499122) has the molecular formula C16H25N3O2 and a molecular weight of 291.39 g/mol. Its IUPAC name is N-(3-methoxyphenyl)-2-[3-methyl-4-(methylamino)piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-(3-methoxyphenyl)-2-[3-methyl-4-(methylamino)piperidin-1-yl]acetamide
PubChem CID114499122
Molecular FormulaC16H25N3O2
Molecular Weight291.39 g/mol
Exact Mass291.19
IUPAC NameN-(3-methoxyphenyl)-2-[3-methyl-4-(methylamino)piperidin-1-yl]acetamide
SMILESCNC1CCN(CC(=O)Nc2cccc(OC)c2)CC1C
InChIInChI=1S/C16H25N3O2/c1-12-10-19(8-7-15(12)17-2)11-16(20)18-13-5-4-6-14(9-13)21-3/h4-6,9,12,15,17H,7-8,10-11H2,1-3H3,(H,18,20)
InChIKeyQIOLWISKYQZWHG-UHFFFAOYSA-N
XLogP1.56
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.39
LogP ≤ 51.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-methoxyphenyl)-2-[3-(methylaminomethyl)pyrrolidin-1-yl]acetamide;hydrochloride
CID 119921880
2-(azocan-1-yl)-N-(3-methoxyphenyl)acetamide
CID 8583685
2-[3-(hydroxymethyl)piperidin-1-yl]-N-(3-methoxyphenyl)acetamide
CID 60642548
N-(3-methoxyphenyl)-2-(4-methylpiperazin-1-yl)acetamide;hydrochloride
CID 2958479
2-[3-(aminomethyl)piperidin-1-yl]-N-(3-methoxyphenyl)acetamide;hydrochloride
CID 119915580
N-(4-fluorophenyl)-2-[4-[2-(3-methoxyanilino)-2-oxoethyl]piperazin-1-yl]acetamide
CID 7336695
2-[4-(cyclohexylmethyl)-1,4-diazepan-1-yl]-N-(3-methoxyphenyl)acetamide
CID 55864033
1-[2-(3,4-dimethoxyanilino)-2-oxoethyl]-N-(3-methoxyphenyl)piperidine-4-carboxamide
CID 16909601
1-[2-(3-methoxyanilino)-2-oxoethyl]-2-methylpyrrolidine-3-carboxylic acid
CID 79370579
(3S,4S)-1-[2-(3-methoxyanilino)-2-oxoethyl]-4-(trifluoromethyl)pyrrolidine-3-carboxylic acid
CID 120953774
N-(3-methoxyphenyl)-2-[(3R)-3-(2-oxopyrrolidin-1-yl)piperidin-1-yl]acetamide
CID 95560043
2-(3-hydroxy-3-methylpyrrolidin-1-yl)-N-(3-methoxyphenyl)acetamide
CID 103728804

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxyphenyl)-2-[3-methyl-4-(methylamino)piperidin-1-yl]acetamide?
The IUPAC name of N-(3-methoxyphenyl)-2-[3-methyl-4-(methylamino)piperidin-1-yl]acetamide (CID 114499122) is N-(3-methoxyphenyl)-2-[3-methyl-4-(methylamino)piperidin-1-yl]acetamide.
What is the SMILES notation for N-(3-methoxyphenyl)-2-[3-methyl-4-(methylamino)piperidin-1-yl]acetamide?
The canonical SMILES for N-(3-methoxyphenyl)-2-[3-methyl-4-(methylamino)piperidin-1-yl]acetamide is CNC1CCN(CC(=O)Nc2cccc(OC)c2)CC1C.
What is the InChIKey of N-(3-methoxyphenyl)-2-[3-methyl-4-(methylamino)piperidin-1-yl]acetamide?
The InChIKey is QIOLWISKYQZWHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O2/c1-12-10-19(8-7-15(12)17-2)11-16(20)18-13-5-4-6-14(9-13)21-3/h4-6,9,12,15,17H,7-8,10-11H2,1-3H3,(H,18,20).
What are the key properties of N-(3-methoxyphenyl)-2-[3-methyl-4-(methylamino)piperidin-1-yl]acetamide?
N-(3-methoxyphenyl)-2-[3-methyl-4-(methylamino)piperidin-1-yl]acetamide has a molecular weight of 291.39 g/mol, XLogP of 1.56, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxyphenyl)-2-[3-methyl-4-(methylamino)piperidin-1-yl]acetamide is sourced from PubChem (CID 114499122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).