N-(cyclopentylcarbamoyl)-2-[4-(2-hydroxyphenyl)piperazin-1-yl]acetamide

C18H26N4O3 — CID 2575953

IUPACN-(cyclopentylcarbamoyl)-2-[4-(2-hydroxyphenyl)piperazin-1-yl]acetamide
SMILESO=C(CN1CCN(c2ccccc2O)CC1)NC(=O)NC1CCCC1
InChIInChI=1S/C18H26N4O3/c23-16-8-4-3-7-15(16)22-11-9-21(10-12-22)13-17(24)20-18(25)19-14-5-1-2-6-14/h3-4,7-8,14,23H,1-2,5-6,9-13H2,(H2,19,20,24,25)
InChIKeyCYNLWMXZXMFXSM-UHFFFAOYSA-N
MW346.43 g/mol
LogP1.28
Rot. Bonds4

About N-(cyclopentylcarbamoyl)-2-[4-(2-hydroxyphenyl)piperazin-1-yl]acetamide

N-(cyclopentylcarbamoyl)-2-[4-(2-hydroxyphenyl)piperazin-1-yl]acetamide (PubChem CID 2575953) has the molecular formula C18H26N4O3 and a molecular weight of 346.43 g/mol. Its IUPAC name is N-(cyclopentylcarbamoyl)-2-[4-(2-hydroxyphenyl)piperazin-1-yl]acetamide.

Molecular Properties

Compound NameN-(cyclopentylcarbamoyl)-2-[4-(2-hydroxyphenyl)piperazin-1-yl]acetamide
PubChem CID2575953
Molecular FormulaC18H26N4O3
Molecular Weight346.43 g/mol
Exact Mass346.20
IUPAC NameN-(cyclopentylcarbamoyl)-2-[4-(2-hydroxyphenyl)piperazin-1-yl]acetamide
SMILESO=C(CN1CCN(c2ccccc2O)CC1)NC(=O)NC1CCCC1
InChIInChI=1S/C18H26N4O3/c23-16-8-4-3-7-15(16)22-11-9-21(10-12-22)13-17(24)20-18(25)19-14-5-1-2-6-14/h3-4,7-8,14,23H,1-2,5-6,9-13H2,(H2,19,20,24,25)
InChIKeyCYNLWMXZXMFXSM-UHFFFAOYSA-N
XLogP1.28
TPSA84.91 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.43
LogP ≤ 51.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopentylcarbamoyl)-2-[4-(2-hydroxyphenyl)piperazin-1-yl]acetamide?
The IUPAC name of N-(cyclopentylcarbamoyl)-2-[4-(2-hydroxyphenyl)piperazin-1-yl]acetamide (CID 2575953) is N-(cyclopentylcarbamoyl)-2-[4-(2-hydroxyphenyl)piperazin-1-yl]acetamide.
What is the SMILES notation for N-(cyclopentylcarbamoyl)-2-[4-(2-hydroxyphenyl)piperazin-1-yl]acetamide?
The canonical SMILES for N-(cyclopentylcarbamoyl)-2-[4-(2-hydroxyphenyl)piperazin-1-yl]acetamide is O=C(CN1CCN(c2ccccc2O)CC1)NC(=O)NC1CCCC1.
What is the InChIKey of N-(cyclopentylcarbamoyl)-2-[4-(2-hydroxyphenyl)piperazin-1-yl]acetamide?
The InChIKey is CYNLWMXZXMFXSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N4O3/c23-16-8-4-3-7-15(16)22-11-9-21(10-12-22)13-17(24)20-18(25)19-14-5-1-2-6-14/h3-4,7-8,14,23H,1-2,5-6,9-13H2,(H2,19,20,24,25).
What are the key properties of N-(cyclopentylcarbamoyl)-2-[4-(2-hydroxyphenyl)piperazin-1-yl]acetamide?
N-(cyclopentylcarbamoyl)-2-[4-(2-hydroxyphenyl)piperazin-1-yl]acetamide has a molecular weight of 346.43 g/mol, XLogP of 1.28, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopentylcarbamoyl)-2-[4-(2-hydroxyphenyl)piperazin-1-yl]acetamide is sourced from PubChem (CID 2575953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).