cyclopentyl-[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]methanone

C18H26N2O2 — CID 110398973

IUPACcyclopentyl-[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]methanone
SMILESCOc1ccccc1CN1CCN(C(=O)C2CCCC2)CC1
InChIInChI=1S/C18H26N2O2/c1-22-17-9-5-4-8-16(17)14-19-10-12-20(13-11-19)18(21)15-6-2-3-7-15/h4-5,8-9,15H,2-3,6-7,10-14H2,1H3
InChIKeyOIOHLZUDNGCVNM-UHFFFAOYSA-N
MW302.42 g/mol
LogP2.53
Rot. Bonds4

About cyclopentyl-[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]methanone

cyclopentyl-[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]methanone (PubChem CID 110398973) has the molecular formula C18H26N2O2 and a molecular weight of 302.42 g/mol. Its IUPAC name is cyclopentyl-[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]methanone.

Molecular Properties

Compound Namecyclopentyl-[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]methanone
PubChem CID110398973
Molecular FormulaC18H26N2O2
Molecular Weight302.42 g/mol
Exact Mass302.20
IUPAC Namecyclopentyl-[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]methanone
SMILESCOc1ccccc1CN1CCN(C(=O)C2CCCC2)CC1
InChIInChI=1S/C18H26N2O2/c1-22-17-9-5-4-8-16(17)14-19-10-12-20(13-11-19)18(21)15-6-2-3-7-15/h4-5,8-9,15H,2-3,6-7,10-14H2,1H3
InChIKeyOIOHLZUDNGCVNM-UHFFFAOYSA-N
XLogP2.53
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.42
LogP ≤ 52.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(4-ethylpiperazin-1-yl)-[1-[(2-methoxyphenyl)methyl]piperidin-4-yl]methanone;oxalic acid
CID 163328426
(2-hydroxycyclopentyl)-[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]methanone
CID 110014493
1-[4-(cyclobutanecarbonyl)-1,4-diazepan-1-yl]-2-(2-methoxyphenyl)ethanone
CID 110799375
1-cyclopropyl-4-[4-[(2-methoxyphenyl)methyl]piperazine-1-carbonyl]pyrrolidin-2-one
CID 70722242
2-[(1R,2S)-2-hydroxycyclohexyl]-1-[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]ethanone
CID 100678175
2-cyclopentyl-1-[4-[(2-methoxyphenyl)methyl]-1,4-diazepan-1-yl]ethanone
CID 136519424
ethyl 1-[1-[(2-methoxyphenyl)methyl]piperidine-4-carbonyl]piperidine-4-carboxylate;oxalic acid
CID 2903679
9-[4-[(2-methoxyphenyl)methyl]piperazine-1-carbonyl]-5-(pyridin-3-ylmethyl)-1,5-diazacycloundecan-2-one
CID 110199622
(3-amino-2-bicyclo[2.2.1]heptanyl)-[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]methanone
CID 119876147
4-(4-ethylpiperazine-1-carbonyl)-N-[(2-methoxyphenyl)methyl]cyclohexane-1-carboxamide
CID 109147502
cyclobutyl-[4-[[2-[2-(dimethylamino)ethoxy]phenyl]methyl]-1,4-diazepan-1-yl]methanone
CID 135120176
4-chloro-1-[(2-methoxyphenyl)methyl]piperidine
CID 63389508

Frequently Asked Questions

What is the IUPAC name of cyclopentyl-[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]methanone?
The IUPAC name of cyclopentyl-[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]methanone (CID 110398973) is cyclopentyl-[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]methanone.
What is the SMILES notation for cyclopentyl-[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]methanone?
The canonical SMILES for cyclopentyl-[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]methanone is COc1ccccc1CN1CCN(C(=O)C2CCCC2)CC1.
What is the InChIKey of cyclopentyl-[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]methanone?
The InChIKey is OIOHLZUDNGCVNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O2/c1-22-17-9-5-4-8-16(17)14-19-10-12-20(13-11-19)18(21)15-6-2-3-7-15/h4-5,8-9,15H,2-3,6-7,10-14H2,1H3.
What are the key properties of cyclopentyl-[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]methanone?
cyclopentyl-[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]methanone has a molecular weight of 302.42 g/mol, XLogP of 2.53, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentyl-[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]methanone is sourced from PubChem (CID 110398973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).