N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]cyclopentanecarboxamide

C19H29N3O2 — CID 10449389

IUPACN-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]cyclopentanecarboxamide
SMILESCOc1ccccc1N1CCN(CCNC(=O)C2CCCC2)CC1
InChIInChI=1S/C19H29N3O2/c1-24-18-9-5-4-8-17(18)22-14-12-21(13-15-22)11-10-20-19(23)16-6-2-3-7-16/h4-5,8-9,16H,2-3,6-7,10-15H2,1H3,(H,20,23)
InChIKeyMASHBMNBCHERNP-UHFFFAOYSA-N
MW331.46 g/mol
LogP2.12
Rot. Bonds6

About N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]cyclopentanecarboxamide

N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]cyclopentanecarboxamide (PubChem CID 10449389) has the molecular formula C19H29N3O2 and a molecular weight of 331.46 g/mol. Its IUPAC name is N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]cyclopentanecarboxamide.

Molecular Properties

Compound NameN-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]cyclopentanecarboxamide
PubChem CID10449389
Molecular FormulaC19H29N3O2
Molecular Weight331.46 g/mol
Exact Mass331.23
IUPAC NameN-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]cyclopentanecarboxamide
SMILESCOc1ccccc1N1CCN(CCNC(=O)C2CCCC2)CC1
InChIInChI=1S/C19H29N3O2/c1-24-18-9-5-4-8-17(18)22-14-12-21(13-15-22)11-10-20-19(23)16-6-2-3-7-16/h4-5,8-9,16H,2-3,6-7,10-15H2,1H3,(H,20,23)
InChIKeyMASHBMNBCHERNP-UHFFFAOYSA-N
XLogP2.12
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.46
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]cyclopentanecarboxamide?
The IUPAC name of N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]cyclopentanecarboxamide (CID 10449389) is N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]cyclopentanecarboxamide.
What is the SMILES notation for N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]cyclopentanecarboxamide?
The canonical SMILES for N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]cyclopentanecarboxamide is COc1ccccc1N1CCN(CCNC(=O)C2CCCC2)CC1.
What is the InChIKey of N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]cyclopentanecarboxamide?
The InChIKey is MASHBMNBCHERNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N3O2/c1-24-18-9-5-4-8-17(18)22-14-12-21(13-15-22)11-10-20-19(23)16-6-2-3-7-16/h4-5,8-9,16H,2-3,6-7,10-15H2,1H3,(H,20,23).
What are the key properties of N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]cyclopentanecarboxamide?
N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]cyclopentanecarboxamide has a molecular weight of 331.46 g/mol, XLogP of 2.12, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]cyclopentanecarboxamide is sourced from PubChem (CID 10449389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).