N-[1-(cycloheptylmethyl)piperidin-4-yl]-2-cyclopentyl-2-hydroxy-2-pyrimidin-2-ylacetamide

C24H38N4O2 — CID 18922107

IUPACN-[1-(cycloheptylmethyl)piperidin-4-yl]-2-cyclopentyl-2-hydroxy-2-pyrimidin-2-ylacetamide
SMILESO=C(NC1CCN(CC2CCCCCC2)CC1)C(O)(c1ncccn1)C1CCCC1
InChIInChI=1S/C24H38N4O2/c29-23(24(30,20-10-5-6-11-20)22-25-14-7-15-26-22)27-21-12-16-28(17-13-21)18-19-8-3-1-2-4-9-19/h7,14-15,19-21,30H,1-6,8-13,16-18H2,(H,27,29)
InChIKeyDGRRETXSVSZGOP-UHFFFAOYSA-N
MW414.59 g/mol
LogP3.41
Rot. Bonds6

About N-[1-(cycloheptylmethyl)piperidin-4-yl]-2-cyclopentyl-2-hydroxy-2-pyrimidin-2-ylacetamide

N-[1-(cycloheptylmethyl)piperidin-4-yl]-2-cyclopentyl-2-hydroxy-2-pyrimidin-2-ylacetamide (PubChem CID 18922107) has the molecular formula C24H38N4O2 and a molecular weight of 414.59 g/mol. Its IUPAC name is N-[1-(cycloheptylmethyl)piperidin-4-yl]-2-cyclopentyl-2-hydroxy-2-pyrimidin-2-ylacetamide.

Molecular Properties

Compound NameN-[1-(cycloheptylmethyl)piperidin-4-yl]-2-cyclopentyl-2-hydroxy-2-pyrimidin-2-ylacetamide
PubChem CID18922107
Molecular FormulaC24H38N4O2
Molecular Weight414.59 g/mol
Exact Mass414.30
IUPAC NameN-[1-(cycloheptylmethyl)piperidin-4-yl]-2-cyclopentyl-2-hydroxy-2-pyrimidin-2-ylacetamide
SMILESO=C(NC1CCN(CC2CCCCCC2)CC1)C(O)(c1ncccn1)C1CCCC1
InChIInChI=1S/C24H38N4O2/c29-23(24(30,20-10-5-6-11-20)22-25-14-7-15-26-22)27-21-12-16-28(17-13-21)18-19-8-3-1-2-4-9-19/h7,14-15,19-21,30H,1-6,8-13,16-18H2,(H,27,29)
InChIKeyDGRRETXSVSZGOP-UHFFFAOYSA-N
XLogP3.41
TPSA78.35 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500414.59
LogP ≤ 53.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[1-(cycloheptylmethyl)piperidin-4-yl]-2-cyclopentyl-2-hydroxy-2-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

2-cyclopentyl-N-[1-(cyclopentylmethyl)piperidin-4-yl]-2-hydroxy-2-phenylacetamide
CID 10810094
N-[1-(cycloheptylmethyl)piperidin-4-yl]-2-cyclopentyl-2-hydroxy-2-(1,2-oxazol-5-yl)acetamide
CID 18922155
2-cyclopentyl-2-hydroxy-N-[1-[[4-(hydroxymethyl)-2-pyridinyl]methyl]piperidin-4-yl]-2-phenylacetamide
CID 23289921
N-[1-(cyclobutylmethyl)piperidin-4-yl]-2,2-dimethylpropanamide
CID 163352611
2-cyclopentyl-2-hydroxy-2-phenyl-N-[1-(quinolin-2-ylmethyl)piperidin-4-yl]acetamide
CID 23289915
N-[1-(cyclopenten-1-ylmethyl)piperidin-4-yl]-2-cyclopentyl-2-hydroxy-2-phenylacetamide
CID 18922005
2-tert-butyl-N-[1-(cyclopentylmethyl)piperidin-4-yl]-1,3-thiazole-5-carboxamide
CID 126770959
N-[1-(cyclopentylmethyl)piperidin-4-yl]-3-phenoxypropanamide
CID 166191503
2-cyclopentyl-2-hydroxy-N-[1-(3-methylpent-4-ynyl)piperidin-4-yl]-2-phenylacetamide
CID 18922142
N-[[1-(cyclohexylmethyl)piperidin-4-yl]-pyridin-2-ylmethyl]-2,2-dimethylpropanamide
CID 110226619
2-cyclopentyl-2-hydroxy-N-[1-[2-(5-methylcyclopenten-1-yl)ethyl]piperidin-4-yl]-2-phenylacetamide
CID 18922048
(E)-but-2-enedioic acid;2-cyclopentyl-2-hydroxy-N-[1-(4-methylpent-3-enyl)piperidin-4-yl]-2-phenylacetamide
CID 18922159

Frequently Asked Questions

What is the IUPAC name of N-[1-(cycloheptylmethyl)piperidin-4-yl]-2-cyclopentyl-2-hydroxy-2-pyrimidin-2-ylacetamide?
The IUPAC name of N-[1-(cycloheptylmethyl)piperidin-4-yl]-2-cyclopentyl-2-hydroxy-2-pyrimidin-2-ylacetamide (CID 18922107) is N-[1-(cycloheptylmethyl)piperidin-4-yl]-2-cyclopentyl-2-hydroxy-2-pyrimidin-2-ylacetamide.
What is the SMILES notation for N-[1-(cycloheptylmethyl)piperidin-4-yl]-2-cyclopentyl-2-hydroxy-2-pyrimidin-2-ylacetamide?
The canonical SMILES for N-[1-(cycloheptylmethyl)piperidin-4-yl]-2-cyclopentyl-2-hydroxy-2-pyrimidin-2-ylacetamide is O=C(NC1CCN(CC2CCCCCC2)CC1)C(O)(c1ncccn1)C1CCCC1.
What is the InChIKey of N-[1-(cycloheptylmethyl)piperidin-4-yl]-2-cyclopentyl-2-hydroxy-2-pyrimidin-2-ylacetamide?
The InChIKey is DGRRETXSVSZGOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H38N4O2/c29-23(24(30,20-10-5-6-11-20)22-25-14-7-15-26-22)27-21-12-16-28(17-13-21)18-19-8-3-1-2-4-9-19/h7,14-15,19-21,30H,1-6,8-13,16-18H2,(H,27,29).
What are the key properties of N-[1-(cycloheptylmethyl)piperidin-4-yl]-2-cyclopentyl-2-hydroxy-2-pyrimidin-2-ylacetamide?
N-[1-(cycloheptylmethyl)piperidin-4-yl]-2-cyclopentyl-2-hydroxy-2-pyrimidin-2-ylacetamide has a molecular weight of 414.59 g/mol, XLogP of 3.41, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(cycloheptylmethyl)piperidin-4-yl]-2-cyclopentyl-2-hydroxy-2-pyrimidin-2-ylacetamide is sourced from PubChem (CID 18922107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).