2-[1-(2-phenylacetyl)piperidin-4-yl]-N-[(1R)-1-pyridin-2-ylethyl]acetamide

C22H27N3O2 — CID 92634093

IUPAC2-[1-(2-phenylacetyl)piperidin-4-yl]-N-[(1R)-1-pyridin-2-ylethyl]acetamide
SMILESC[C@@H](NC(=O)CC1CCN(C(=O)Cc2ccccc2)CC1)c1ccccn1
InChIInChI=1S/C22H27N3O2/c1-17(20-9-5-6-12-23-20)24-21(26)15-19-10-13-25(14-11-19)22(27)16-18-7-3-2-4-8-18/h2-9,12,17,19H,10-11,13-16H2,1H3,(H,24,26)/t17-/m1/s1
InChIKeyHUTPKYZGJKDBEE-QGZVFWFLSA-N
MW365.48 g/mol
LogP3.13
Rot. Bonds6

About 2-[1-(2-phenylacetyl)piperidin-4-yl]-N-[(1R)-1-pyridin-2-ylethyl]acetamide

2-[1-(2-phenylacetyl)piperidin-4-yl]-N-[(1R)-1-pyridin-2-ylethyl]acetamide (PubChem CID 92634093) has the molecular formula C22H27N3O2 and a molecular weight of 365.48 g/mol. Its IUPAC name is 2-[1-(2-phenylacetyl)piperidin-4-yl]-N-[(1R)-1-pyridin-2-ylethyl]acetamide.

Molecular Properties

Compound Name2-[1-(2-phenylacetyl)piperidin-4-yl]-N-[(1R)-1-pyridin-2-ylethyl]acetamide
PubChem CID92634093
Molecular FormulaC22H27N3O2
Molecular Weight365.48 g/mol
Exact Mass365.21
IUPAC Name2-[1-(2-phenylacetyl)piperidin-4-yl]-N-[(1R)-1-pyridin-2-ylethyl]acetamide
SMILESC[C@@H](NC(=O)CC1CCN(C(=O)Cc2ccccc2)CC1)c1ccccn1
InChIInChI=1S/C22H27N3O2/c1-17(20-9-5-6-12-23-20)24-21(26)15-19-10-13-25(14-11-19)22(27)16-18-7-3-2-4-8-18/h2-9,12,17,19H,10-11,13-16H2,1H3,(H,24,26)/t17-/m1/s1
InChIKeyHUTPKYZGJKDBEE-QGZVFWFLSA-N
XLogP3.13
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.48
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[1-(2-methylpropanoyl)piperidin-4-yl]-N-[(1R)-1-pyridin-2-ylethyl]acetamide
CID 92634096
2-piperidin-4-yl-N-(1-pyridin-2-ylethyl)acetamide
CID 54910208
2-(azetidin-3-yl)-N-[(1S)-1-pyridin-2-ylethyl]acetamide
CID 81406682
2-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]-N-[(1R)-1-pyridin-2-ylethyl]acetamide
CID 92634141
2-[1-(3-fluorophenyl)sulfonylpiperidin-4-yl]-N-[(1R)-1-pyridin-2-ylethyl]acetamide
CID 92634143
2-[1-(3-fluorophenyl)sulfonylpiperidin-4-yl]-N-(1-pyridin-2-ylethyl)acetamide
CID 110246280
2-[1-(2-phenylacetyl)piperidin-4-yl]acetic acid
CID 28997512
2-(4-methylphenyl)-N-[(1R)-1-pyridin-2-ylethyl]acetamide
CID 25337547
2-[1-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]piperidin-4-yl]-N-[(1S)-1-phenylethyl]acetamide
CID 92633969
4-methyl-N-(1-pyridin-2-ylethyl)piperidine-1-carboxamide
CID 113223974
2-[1-(1-pyridin-2-ylethylcarbamoyl)azetidin-3-yl]acetic acid
CID 64618419
N-[(1R)-1-pyridin-2-ylethyl]propanamide
CID 59509331

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-phenylacetyl)piperidin-4-yl]-N-[(1R)-1-pyridin-2-ylethyl]acetamide?
The IUPAC name of 2-[1-(2-phenylacetyl)piperidin-4-yl]-N-[(1R)-1-pyridin-2-ylethyl]acetamide (CID 92634093) is 2-[1-(2-phenylacetyl)piperidin-4-yl]-N-[(1R)-1-pyridin-2-ylethyl]acetamide.
What is the SMILES notation for 2-[1-(2-phenylacetyl)piperidin-4-yl]-N-[(1R)-1-pyridin-2-ylethyl]acetamide?
The canonical SMILES for 2-[1-(2-phenylacetyl)piperidin-4-yl]-N-[(1R)-1-pyridin-2-ylethyl]acetamide is C[C@@H](NC(=O)CC1CCN(C(=O)Cc2ccccc2)CC1)c1ccccn1.
What is the InChIKey of 2-[1-(2-phenylacetyl)piperidin-4-yl]-N-[(1R)-1-pyridin-2-ylethyl]acetamide?
The InChIKey is HUTPKYZGJKDBEE-QGZVFWFLSA-N. The full InChI is InChI=1S/C22H27N3O2/c1-17(20-9-5-6-12-23-20)24-21(26)15-19-10-13-25(14-11-19)22(27)16-18-7-3-2-4-8-18/h2-9,12,17,19H,10-11,13-16H2,1H3,(H,24,26)/t17-/m1/s1.
What are the key properties of 2-[1-(2-phenylacetyl)piperidin-4-yl]-N-[(1R)-1-pyridin-2-ylethyl]acetamide?
2-[1-(2-phenylacetyl)piperidin-4-yl]-N-[(1R)-1-pyridin-2-ylethyl]acetamide has a molecular weight of 365.48 g/mol, XLogP of 3.13, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-phenylacetyl)piperidin-4-yl]-N-[(1R)-1-pyridin-2-ylethyl]acetamide is sourced from PubChem (CID 92634093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).