N-(1,3-dimethylpyrazol-4-yl)-2-[4-(2-methylphenoxy)piperidin-1-yl]acetamide

C19H26N4O2 — CID 46981177

IUPACN-(1,3-dimethylpyrazol-4-yl)-2-[4-(2-methylphenoxy)piperidin-1-yl]acetamide
SMILESCc1ccccc1OC1CCN(CC(=O)Nc2cn(C)nc2C)CC1
InChIInChI=1S/C19H26N4O2/c1-14-6-4-5-7-18(14)25-16-8-10-23(11-9-16)13-19(24)20-17-12-22(3)21-15(17)2/h4-7,12,16H,8-11,13H2,1-3H3,(H,20,24)
InChIKeyOBHHNNLPXWHQRV-UHFFFAOYSA-N
MW342.44 g/mol
LogP2.52
Rot. Bonds5

About N-(1,3-dimethylpyrazol-4-yl)-2-[4-(2-methylphenoxy)piperidin-1-yl]acetamide

N-(1,3-dimethylpyrazol-4-yl)-2-[4-(2-methylphenoxy)piperidin-1-yl]acetamide (PubChem CID 46981177) has the molecular formula C19H26N4O2 and a molecular weight of 342.44 g/mol. Its IUPAC name is N-(1,3-dimethylpyrazol-4-yl)-2-[4-(2-methylphenoxy)piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-(1,3-dimethylpyrazol-4-yl)-2-[4-(2-methylphenoxy)piperidin-1-yl]acetamide
PubChem CID46981177
Molecular FormulaC19H26N4O2
Molecular Weight342.44 g/mol
Exact Mass342.21
IUPAC NameN-(1,3-dimethylpyrazol-4-yl)-2-[4-(2-methylphenoxy)piperidin-1-yl]acetamide
SMILESCc1ccccc1OC1CCN(CC(=O)Nc2cn(C)nc2C)CC1
InChIInChI=1S/C19H26N4O2/c1-14-6-4-5-7-18(14)25-16-8-10-23(11-9-16)13-19(24)20-17-12-22(3)21-15(17)2/h4-7,12,16H,8-11,13H2,1-3H3,(H,20,24)
InChIKeyOBHHNNLPXWHQRV-UHFFFAOYSA-N
XLogP2.52
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.44
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-imidazol-1-ylphenyl)-2-[4-(2-methylphenoxy)piperidin-1-yl]acetamide
CID 46979416
2-[4-(2-methylphenoxy)piperidin-1-yl]-N-[4-(tetrazol-1-yl)phenyl]acetamide
CID 46979424
N-(1,3-dimethylpyrazol-4-yl)-2-[(3R)-3-[(3-methoxyphenoxy)methyl]piperidin-1-yl]acetamide
CID 92613112
2-[4-(methylamino)piperidin-1-yl]-N-(2-methylphenyl)acetamide
CID 60818956
2-(4-methyl-1,4-diazepan-1-yl)-1-[4-(2-methylphenoxy)piperidin-1-yl]ethanone
CID 90650172
N-(1,3-dimethylpyrazol-4-yl)-2-[(3S,4R)-3-hydroxy-4-(pyridin-4-ylmethyl)pyrrolidin-1-yl]acetamide
CID 135092936
2-[4-(1,3-benzothiazol-2-yl)-1,4-diazepan-1-yl]-N-(1,3-dimethylpyrazol-4-yl)acetamide
CID 91843016
N-(2-tert-butyl-5-methylpyrazol-3-yl)-2-(4-phenoxypiperidin-1-yl)acetamide
CID 47544876
4-benzyl-1-[2-[(1,3-dimethylpyrazol-4-yl)amino]-2-oxoethyl]piperazine-2-carboxamide
CID 110122356
(2R)-4-benzyl-1-[2-[(1,3-dimethylpyrazol-4-yl)amino]-2-oxoethyl]piperazine-2-carboxamide
CID 124957917
N-(1,3-dimethylpyrazol-4-yl)-2-[(3S,4R)-3-(methanesulfonamido)-4-propylpyrrolidin-1-yl]acetamide
CID 72890020
N-[1-[2-(2-ethoxyanilino)-2-oxoethyl]piperidin-4-yl]-2-methylbenzamide
CID 3220803

Frequently Asked Questions

What is the IUPAC name of N-(1,3-dimethylpyrazol-4-yl)-2-[4-(2-methylphenoxy)piperidin-1-yl]acetamide?
The IUPAC name of N-(1,3-dimethylpyrazol-4-yl)-2-[4-(2-methylphenoxy)piperidin-1-yl]acetamide (CID 46981177) is N-(1,3-dimethylpyrazol-4-yl)-2-[4-(2-methylphenoxy)piperidin-1-yl]acetamide.
What is the SMILES notation for N-(1,3-dimethylpyrazol-4-yl)-2-[4-(2-methylphenoxy)piperidin-1-yl]acetamide?
The canonical SMILES for N-(1,3-dimethylpyrazol-4-yl)-2-[4-(2-methylphenoxy)piperidin-1-yl]acetamide is Cc1ccccc1OC1CCN(CC(=O)Nc2cn(C)nc2C)CC1.
What is the InChIKey of N-(1,3-dimethylpyrazol-4-yl)-2-[4-(2-methylphenoxy)piperidin-1-yl]acetamide?
The InChIKey is OBHHNNLPXWHQRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O2/c1-14-6-4-5-7-18(14)25-16-8-10-23(11-9-16)13-19(24)20-17-12-22(3)21-15(17)2/h4-7,12,16H,8-11,13H2,1-3H3,(H,20,24).
What are the key properties of N-(1,3-dimethylpyrazol-4-yl)-2-[4-(2-methylphenoxy)piperidin-1-yl]acetamide?
N-(1,3-dimethylpyrazol-4-yl)-2-[4-(2-methylphenoxy)piperidin-1-yl]acetamide has a molecular weight of 342.44 g/mol, XLogP of 2.52, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-dimethylpyrazol-4-yl)-2-[4-(2-methylphenoxy)piperidin-1-yl]acetamide is sourced from PubChem (CID 46981177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).