N-[(2-cyclopentyloxyphenyl)methyl]-2-(2-pyridin-3-ylpiperazin-1-yl)acetamide

C23H30N4O2 — CID 120755780

IUPACN-[(2-cyclopentyloxyphenyl)methyl]-2-(2-pyridin-3-ylpiperazin-1-yl)acetamide
SMILESO=C(CN1CCNCC1c1cccnc1)NCc1ccccc1OC1CCCC1
InChIInChI=1S/C23H30N4O2/c28-23(17-27-13-12-25-16-21(27)18-7-5-11-24-14-18)26-15-19-6-1-4-10-22(19)29-20-8-2-3-9-20/h1,4-7,10-11,14,20-21,25H,2-3,8-9,12-13,15-17H2,(H,26,28)
InChIKeyWHVBKYQQTWZTRC-UHFFFAOYSA-N
MW394.52 g/mol
LogP2.67
Rot. Bonds7

About N-[(2-cyclopentyloxyphenyl)methyl]-2-(2-pyridin-3-ylpiperazin-1-yl)acetamide

N-[(2-cyclopentyloxyphenyl)methyl]-2-(2-pyridin-3-ylpiperazin-1-yl)acetamide (PubChem CID 120755780) has the molecular formula C23H30N4O2 and a molecular weight of 394.52 g/mol. Its IUPAC name is N-[(2-cyclopentyloxyphenyl)methyl]-2-(2-pyridin-3-ylpiperazin-1-yl)acetamide.

Molecular Properties

Compound NameN-[(2-cyclopentyloxyphenyl)methyl]-2-(2-pyridin-3-ylpiperazin-1-yl)acetamide
PubChem CID120755780
Molecular FormulaC23H30N4O2
Molecular Weight394.52 g/mol
Exact Mass394.24
IUPAC NameN-[(2-cyclopentyloxyphenyl)methyl]-2-(2-pyridin-3-ylpiperazin-1-yl)acetamide
SMILESO=C(CN1CCNCC1c1cccnc1)NCc1ccccc1OC1CCCC1
InChIInChI=1S/C23H30N4O2/c28-23(17-27-13-12-25-16-21(27)18-7-5-11-24-14-18)26-15-19-6-1-4-10-22(19)29-20-8-2-3-9-20/h1,4-7,10-11,14,20-21,25H,2-3,8-9,12-13,15-17H2,(H,26,28)
InChIKeyWHVBKYQQTWZTRC-UHFFFAOYSA-N
XLogP2.67
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.52
LogP ≤ 52.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[(2-cyclopentyloxyphenyl)methyl]-2-(2-pyridin-3-ylpiperazin-1-yl)acetamide 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-2-(2-pyridin-3-ylpiperazin-1-yl)acetamide;hydrochloride
CID 120755244
N-[2-(2-methoxyphenyl)ethyl]-2-(2-pyridin-3-ylpiperazin-1-yl)acetamide;hydrochloride
CID 120754400
N-(2-oxo-2-pyrrolidin-1-ylethyl)-2-(2-pyridin-3-ylpiperazin-1-yl)acetamide
CID 120754481
2-(2-pyridin-3-ylpiperazin-1-yl)-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]acetamide
CID 120755838
N-(2-methoxyphenyl)-2-(2-pyridin-3-ylpiperazin-1-yl)acetamide
CID 120754525
N-[(4-methylphenyl)methyl]-2-(2-pyridin-3-ylpiperazin-1-yl)acetamide;hydrochloride
CID 120754234
N-(benzylcarbamoyl)-2-(2-pyridin-3-ylpiperazin-1-yl)acetamide
CID 120755361
N-(4-fluorophenyl)-2-(2-pyridin-3-ylpiperazin-1-yl)acetamide;hydrochloride
CID 120755246
N-[2-(2,6-dimethylphenoxy)ethyl]-2-(2-pyridin-3-ylpiperazin-1-yl)acetamide
CID 120755786
N-(1,3-benzodioxol-5-ylmethyl)-2-(2-pyridin-3-ylpiperazin-1-yl)acetamide
CID 120755646
1-[[2-(difluoromethoxy)phenyl]methyl]-2-pyridin-3-ylpiperazine
CID 120754669
N-(cyclopropylcarbamoyl)-2-(2-pyridin-3-ylpiperazin-1-yl)acetamide;hydrochloride
CID 120755106

Frequently Asked Questions

What is the IUPAC name of N-[(2-cyclopentyloxyphenyl)methyl]-2-(2-pyridin-3-ylpiperazin-1-yl)acetamide?
The IUPAC name of N-[(2-cyclopentyloxyphenyl)methyl]-2-(2-pyridin-3-ylpiperazin-1-yl)acetamide (CID 120755780) is N-[(2-cyclopentyloxyphenyl)methyl]-2-(2-pyridin-3-ylpiperazin-1-yl)acetamide.
What is the SMILES notation for N-[(2-cyclopentyloxyphenyl)methyl]-2-(2-pyridin-3-ylpiperazin-1-yl)acetamide?
The canonical SMILES for N-[(2-cyclopentyloxyphenyl)methyl]-2-(2-pyridin-3-ylpiperazin-1-yl)acetamide is O=C(CN1CCNCC1c1cccnc1)NCc1ccccc1OC1CCCC1.
What is the InChIKey of N-[(2-cyclopentyloxyphenyl)methyl]-2-(2-pyridin-3-ylpiperazin-1-yl)acetamide?
The InChIKey is WHVBKYQQTWZTRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N4O2/c28-23(17-27-13-12-25-16-21(27)18-7-5-11-24-14-18)26-15-19-6-1-4-10-22(19)29-20-8-2-3-9-20/h1,4-7,10-11,14,20-21,25H,2-3,8-9,12-13,15-17H2,(H,26,28).
What are the key properties of N-[(2-cyclopentyloxyphenyl)methyl]-2-(2-pyridin-3-ylpiperazin-1-yl)acetamide?
N-[(2-cyclopentyloxyphenyl)methyl]-2-(2-pyridin-3-ylpiperazin-1-yl)acetamide has a molecular weight of 394.52 g/mol, XLogP of 2.67, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-cyclopentyloxyphenyl)methyl]-2-(2-pyridin-3-ylpiperazin-1-yl)acetamide is sourced from PubChem (CID 120755780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).