N-(2-ethylphenyl)-2-[1-(2-methoxypyrimidin-4-yl)piperidin-4-yl]acetamide

C20H26N4O2 — CID 53189238

IUPACN-(2-ethylphenyl)-2-[1-(2-methoxypyrimidin-4-yl)piperidin-4-yl]acetamide
SMILESCCc1ccccc1NC(=O)CC1CCN(c2ccnc(OC)n2)CC1
InChIInChI=1S/C20H26N4O2/c1-3-16-6-4-5-7-17(16)22-19(25)14-15-9-12-24(13-10-15)18-8-11-21-20(23-18)26-2/h4-8,11,15H,3,9-10,12-14H2,1-2H3,(H,22,25)
InChIKeyPWCDCEYOGFVRGH-UHFFFAOYSA-N
MW354.45 g/mol
LogP3.29
Rot. Bonds6

About N-(2-ethylphenyl)-2-[1-(2-methoxypyrimidin-4-yl)piperidin-4-yl]acetamide

N-(2-ethylphenyl)-2-[1-(2-methoxypyrimidin-4-yl)piperidin-4-yl]acetamide (PubChem CID 53189238) has the molecular formula C20H26N4O2 and a molecular weight of 354.45 g/mol. Its IUPAC name is N-(2-ethylphenyl)-2-[1-(2-methoxypyrimidin-4-yl)piperidin-4-yl]acetamide.

Molecular Properties

Compound NameN-(2-ethylphenyl)-2-[1-(2-methoxypyrimidin-4-yl)piperidin-4-yl]acetamide
PubChem CID53189238
Molecular FormulaC20H26N4O2
Molecular Weight354.45 g/mol
Exact Mass354.21
IUPAC NameN-(2-ethylphenyl)-2-[1-(2-methoxypyrimidin-4-yl)piperidin-4-yl]acetamide
SMILESCCc1ccccc1NC(=O)CC1CCN(c2ccnc(OC)n2)CC1
InChIInChI=1S/C20H26N4O2/c1-3-16-6-4-5-7-17(16)22-19(25)14-15-9-12-24(13-10-15)18-8-11-21-20(23-18)26-2/h4-8,11,15H,3,9-10,12-14H2,1-2H3,(H,22,25)
InChIKeyPWCDCEYOGFVRGH-UHFFFAOYSA-N
XLogP3.29
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.45
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2,4-dimethylphenyl)-2-[1-(2-methoxypyrimidin-4-yl)piperidin-4-yl]acetamide
CID 53189218
N-(4-methoxy-2-methylphenyl)-2-[1-(2-methoxypyrimidin-4-yl)piperidin-4-yl]acetamide
CID 53189262
N-(2-ethylphenyl)-2-(1-methylpiperidin-4-yl)acetamide
CID 95969544
1-[2-(2-ethylanilino)pyrimidin-4-yl]piperidine-4-carboxylic acid
CID 113193987
1-(2-methoxypyrimidin-4-yl)-N-methyl-N-(naphthalen-1-ylmethyl)piperidin-4-amine
CID 118190332
5-(2-methoxypyrimidin-4-yl)-5-azaspiro[2.5]octane-8-carbonyl chloride
CID 155273088
2-[4-[(2-ethylphenyl)carbamoyl]piperidin-1-yl]-N-(2-methoxyphenyl)pyridine-4-carboxamide
CID 46360651
2-cyclopentyl-N-[2-(ethylaminomethyl)phenyl]acetamide
CID 60776430
N-[2-(chloromethyl)phenyl]-2-cyclopropylacetamide
CID 114298279
N-(2-ethylphenyl)-2-(1-methylpiperidin-2-yl)acetamide
CID 110857732
2-cyclopentyl-N-[2-(pyrrolidin-1-ylmethyl)phenyl]acetamide
CID 71896430
N-(2-ethylphenyl)-1-[6-(2-methylimidazol-1-yl)pyrimidin-4-yl]piperidine-4-carboxamide
CID 90520046

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylphenyl)-2-[1-(2-methoxypyrimidin-4-yl)piperidin-4-yl]acetamide?
The IUPAC name of N-(2-ethylphenyl)-2-[1-(2-methoxypyrimidin-4-yl)piperidin-4-yl]acetamide (CID 53189238) is N-(2-ethylphenyl)-2-[1-(2-methoxypyrimidin-4-yl)piperidin-4-yl]acetamide.
What is the SMILES notation for N-(2-ethylphenyl)-2-[1-(2-methoxypyrimidin-4-yl)piperidin-4-yl]acetamide?
The canonical SMILES for N-(2-ethylphenyl)-2-[1-(2-methoxypyrimidin-4-yl)piperidin-4-yl]acetamide is CCc1ccccc1NC(=O)CC1CCN(c2ccnc(OC)n2)CC1.
What is the InChIKey of N-(2-ethylphenyl)-2-[1-(2-methoxypyrimidin-4-yl)piperidin-4-yl]acetamide?
The InChIKey is PWCDCEYOGFVRGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N4O2/c1-3-16-6-4-5-7-17(16)22-19(25)14-15-9-12-24(13-10-15)18-8-11-21-20(23-18)26-2/h4-8,11,15H,3,9-10,12-14H2,1-2H3,(H,22,25).
What are the key properties of N-(2-ethylphenyl)-2-[1-(2-methoxypyrimidin-4-yl)piperidin-4-yl]acetamide?
N-(2-ethylphenyl)-2-[1-(2-methoxypyrimidin-4-yl)piperidin-4-yl]acetamide has a molecular weight of 354.45 g/mol, XLogP of 3.29, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylphenyl)-2-[1-(2-methoxypyrimidin-4-yl)piperidin-4-yl]acetamide is sourced from PubChem (CID 53189238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).