N-(1-cyclopentylpiperidin-4-yl)-2-phenyl-N-pyrimidin-2-ylacetamide

C22H28N4O — CID 21315846

IUPACN-(1-cyclopentylpiperidin-4-yl)-2-phenyl-N-pyrimidin-2-ylacetamide
SMILESO=C(Cc1ccccc1)N(c1ncccn1)C1CCN(C2CCCC2)CC1
InChIInChI=1S/C22H28N4O/c27-21(17-18-7-2-1-3-8-18)26(22-23-13-6-14-24-22)20-11-15-25(16-12-20)19-9-4-5-10-19/h1-3,6-8,13-14,19-20H,4-5,9-12,15-17H2
InChIKeyJMLAJRVVGRXSOY-UHFFFAOYSA-N
MW364.49 g/mol
LogP3.46
Rot. Bonds5

About N-(1-cyclopentylpiperidin-4-yl)-2-phenyl-N-pyrimidin-2-ylacetamide

N-(1-cyclopentylpiperidin-4-yl)-2-phenyl-N-pyrimidin-2-ylacetamide (PubChem CID 21315846) has the molecular formula C22H28N4O and a molecular weight of 364.49 g/mol. Its IUPAC name is N-(1-cyclopentylpiperidin-4-yl)-2-phenyl-N-pyrimidin-2-ylacetamide.

Molecular Properties

Compound NameN-(1-cyclopentylpiperidin-4-yl)-2-phenyl-N-pyrimidin-2-ylacetamide
PubChem CID21315846
Molecular FormulaC22H28N4O
Molecular Weight364.49 g/mol
Exact Mass364.23
IUPAC NameN-(1-cyclopentylpiperidin-4-yl)-2-phenyl-N-pyrimidin-2-ylacetamide
SMILESO=C(Cc1ccccc1)N(c1ncccn1)C1CCN(C2CCCC2)CC1
InChIInChI=1S/C22H28N4O/c27-21(17-18-7-2-1-3-8-18)26(22-23-13-6-14-24-22)20-11-15-25(16-12-20)19-9-4-5-10-19/h1-3,6-8,13-14,19-20H,4-5,9-12,15-17H2
InChIKeyJMLAJRVVGRXSOY-UHFFFAOYSA-N
XLogP3.46
TPSA49.33 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.49
LogP ≤ 53.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-(1-cyclopentylpiperidin-4-yl)-2-phenyl-N-pyrimidin-2-ylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-benzyl-1-cyclohexyl-N-methylpiperidin-4-amine;oxalic acid
CID 17369346
N-[[6-(4-cyclopentylpiperazin-1-yl)-3-pyridinyl]methyl]-2-phenylacetamide
CID 11567045
N-[1-(2-phenylethyl)piperidin-4-yl]-N-pyrimidin-2-ylfuran-2-carboxamide
CID 10429616
N-cyclopentyl-2-phenyl-N-(1,3-thiazol-2-ylmethyl)acetamide
CID 158834559
2-[cyclopentyl-(2-phenylacetyl)amino]acetic acid
CID 54926378
N-(1,1-dioxothiolan-3-yl)-2-phenyl-N-pyridin-2-ylacetamide
CID 102566160
1-[4-(azepan-1-yl)piperidin-1-yl]-2-phenylethanone
CID 1121449
1-benzyl-4-cyclohexylpiperazine;oxalic acid
CID 126476719
N-methyl-2-phenyl-N-[(1R,2S)-2-pyrrolidin-1-ylcyclohexyl]acetamide
CID 46878006
N-(3-methoxyphenyl)-2-phenyl-N-[1-[(1R,2R)-2-phenylcyclohexyl]piperidin-4-yl]acetamide
CID 91306761
1-benzyl-3-(1-cyclopentylpiperidin-4-yl)-1-(2-hydroxyethyl)urea
CID 111751499
oxalic acid;2-phenyl-1-(4-pyrrolidin-1-ylpiperidin-1-yl)ethanone
CID 2912760

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopentylpiperidin-4-yl)-2-phenyl-N-pyrimidin-2-ylacetamide?
The IUPAC name of N-(1-cyclopentylpiperidin-4-yl)-2-phenyl-N-pyrimidin-2-ylacetamide (CID 21315846) is N-(1-cyclopentylpiperidin-4-yl)-2-phenyl-N-pyrimidin-2-ylacetamide.
What is the SMILES notation for N-(1-cyclopentylpiperidin-4-yl)-2-phenyl-N-pyrimidin-2-ylacetamide?
The canonical SMILES for N-(1-cyclopentylpiperidin-4-yl)-2-phenyl-N-pyrimidin-2-ylacetamide is O=C(Cc1ccccc1)N(c1ncccn1)C1CCN(C2CCCC2)CC1.
What is the InChIKey of N-(1-cyclopentylpiperidin-4-yl)-2-phenyl-N-pyrimidin-2-ylacetamide?
The InChIKey is JMLAJRVVGRXSOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N4O/c27-21(17-18-7-2-1-3-8-18)26(22-23-13-6-14-24-22)20-11-15-25(16-12-20)19-9-4-5-10-19/h1-3,6-8,13-14,19-20H,4-5,9-12,15-17H2.
What are the key properties of N-(1-cyclopentylpiperidin-4-yl)-2-phenyl-N-pyrimidin-2-ylacetamide?
N-(1-cyclopentylpiperidin-4-yl)-2-phenyl-N-pyrimidin-2-ylacetamide has a molecular weight of 364.49 g/mol, XLogP of 3.46, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopentylpiperidin-4-yl)-2-phenyl-N-pyrimidin-2-ylacetamide is sourced from PubChem (CID 21315846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).