cyclopropyl-[3-(2-methoxyphenyl)-4-methylpiperazin-1-yl]methanone

C16H22N2O2 — CID 110293137

IUPACcyclopropyl-[3-(2-methoxyphenyl)-4-methylpiperazin-1-yl]methanone
SMILESCOc1ccccc1C1CN(C(=O)C2CC2)CCN1C
InChIInChI=1S/C16H22N2O2/c1-17-9-10-18(16(19)12-7-8-12)11-14(17)13-5-3-4-6-15(13)20-2/h3-6,12,14H,7-11H2,1-2H3
InChIKeyGNOPFLVRTBXFMM-UHFFFAOYSA-N
MW274.36 g/mol
LogP1.92
Rot. Bonds3

About cyclopropyl-[3-(2-methoxyphenyl)-4-methylpiperazin-1-yl]methanone

cyclopropyl-[3-(2-methoxyphenyl)-4-methylpiperazin-1-yl]methanone (PubChem CID 110293137) has the molecular formula C16H22N2O2 and a molecular weight of 274.36 g/mol. Its IUPAC name is cyclopropyl-[3-(2-methoxyphenyl)-4-methylpiperazin-1-yl]methanone.

Molecular Properties

Compound Namecyclopropyl-[3-(2-methoxyphenyl)-4-methylpiperazin-1-yl]methanone
PubChem CID110293137
Molecular FormulaC16H22N2O2
Molecular Weight274.36 g/mol
Exact Mass274.17
IUPAC Namecyclopropyl-[3-(2-methoxyphenyl)-4-methylpiperazin-1-yl]methanone
SMILESCOc1ccccc1C1CN(C(=O)C2CC2)CCN1C
InChIInChI=1S/C16H22N2O2/c1-17-9-10-18(16(19)12-7-8-12)11-14(17)13-5-3-4-6-15(13)20-2/h3-6,12,14H,7-11H2,1-2H3
InChIKeyGNOPFLVRTBXFMM-UHFFFAOYSA-N
XLogP1.92
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 51.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze cyclopropyl-[3-(2-methoxyphenyl)-4-methylpiperazin-1-yl]methanone 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

1-[3-(2-methoxyphenyl)-4-methylpiperazin-1-yl]ethanone
CID 112507549
2-amino-1-[3-(2-methoxyphenyl)-4-methylpiperazin-1-yl]ethanone
CID 110096819
N,N-diethyl-3-(2-methoxyphenyl)-4-methylpiperazine-1-carboxamide
CID 110293203
1-[3-(2-methoxyphenyl)-4-methylpiperazin-1-yl]-3-methylbutan-1-one
CID 110293139
[3-(2-methoxyphenyl)-4-methylpiperazin-1-yl]-(1-methylpyrrol-2-yl)methanone
CID 110109648
1-[3-(2-methoxyphenyl)-4-methylpiperazin-1-yl]pentan-1-one
CID 110293138
[(3S)-3-(2-methoxyphenyl)-4-methylpiperazin-1-yl]-(1,3-thiazol-5-yl)methanone
CID 124973894
[(3R)-3-(2-methoxyphenyl)-4-methylpiperazin-1-yl]-(6-methyl-3-pyridinyl)methanone
CID 124992452
1-[3-(2-methoxyphenyl)-4-methylpiperazin-1-yl]-3-methylsulfonylpropan-1-one
CID 110631963
1-[3-(2-methoxyphenyl)-4-methylpiperazin-1-yl]-2-pyrazol-1-ylethanone
CID 110098353
(3-bromophenyl)-[3-(2-methoxyphenyl)-4-methylpiperazin-1-yl]methanone
CID 110293154
3-cyclopropyl-1-[3-(2-methoxyphenyl)-4-methylpiperazin-1-yl]-3-phenylpropan-1-one
CID 110310525

Frequently Asked Questions

What is the IUPAC name of cyclopropyl-[3-(2-methoxyphenyl)-4-methylpiperazin-1-yl]methanone?
The IUPAC name of cyclopropyl-[3-(2-methoxyphenyl)-4-methylpiperazin-1-yl]methanone (CID 110293137) is cyclopropyl-[3-(2-methoxyphenyl)-4-methylpiperazin-1-yl]methanone.
What is the SMILES notation for cyclopropyl-[3-(2-methoxyphenyl)-4-methylpiperazin-1-yl]methanone?
The canonical SMILES for cyclopropyl-[3-(2-methoxyphenyl)-4-methylpiperazin-1-yl]methanone is COc1ccccc1C1CN(C(=O)C2CC2)CCN1C.
What is the InChIKey of cyclopropyl-[3-(2-methoxyphenyl)-4-methylpiperazin-1-yl]methanone?
The InChIKey is GNOPFLVRTBXFMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O2/c1-17-9-10-18(16(19)12-7-8-12)11-14(17)13-5-3-4-6-15(13)20-2/h3-6,12,14H,7-11H2,1-2H3.
What are the key properties of cyclopropyl-[3-(2-methoxyphenyl)-4-methylpiperazin-1-yl]methanone?
cyclopropyl-[3-(2-methoxyphenyl)-4-methylpiperazin-1-yl]methanone has a molecular weight of 274.36 g/mol, XLogP of 1.92, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl-[3-(2-methoxyphenyl)-4-methylpiperazin-1-yl]methanone is sourced from PubChem (CID 110293137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).