(4-methoxypiperazin-1-yl)-(1-methylcyclopropyl)methanone

C10H18N2O2 — CID 59857740

IUPAC(4-methoxypiperazin-1-yl)-(1-methylcyclopropyl)methanone
SMILESCON1CCN(C(=O)C2(C)CC2)CC1
InChIInChI=1S/C10H18N2O2/c1-10(3-4-10)9(13)11-5-7-12(14-2)8-6-11/h3-8H2,1-2H3
InChIKeyONSVFHGNLIWUBI-UHFFFAOYSA-N
MW198.27 g/mol
LogP0.49
Rot. Bonds2

About (4-methoxypiperazin-1-yl)-(1-methylcyclopropyl)methanone

(4-methoxypiperazin-1-yl)-(1-methylcyclopropyl)methanone (PubChem CID 59857740) has the molecular formula C10H18N2O2 and a molecular weight of 198.27 g/mol. Its IUPAC name is (4-methoxypiperazin-1-yl)-(1-methylcyclopropyl)methanone.

Molecular Properties

Compound Name(4-methoxypiperazin-1-yl)-(1-methylcyclopropyl)methanone
PubChem CID59857740
Molecular FormulaC10H18N2O2
Molecular Weight198.27 g/mol
Exact Mass198.14
IUPAC Name(4-methoxypiperazin-1-yl)-(1-methylcyclopropyl)methanone
SMILESCON1CCN(C(=O)C2(C)CC2)CC1
InChIInChI=1S/C10H18N2O2/c1-10(3-4-10)9(13)11-5-7-12(14-2)8-6-11/h3-8H2,1-2H3
InChIKeyONSVFHGNLIWUBI-UHFFFAOYSA-N
XLogP0.49
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 50.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (4-methoxypiperazin-1-yl)-(1-methylcyclopropyl)methanone?
The IUPAC name of (4-methoxypiperazin-1-yl)-(1-methylcyclopropyl)methanone (CID 59857740) is (4-methoxypiperazin-1-yl)-(1-methylcyclopropyl)methanone.
What is the SMILES notation for (4-methoxypiperazin-1-yl)-(1-methylcyclopropyl)methanone?
The canonical SMILES for (4-methoxypiperazin-1-yl)-(1-methylcyclopropyl)methanone is CON1CCN(C(=O)C2(C)CC2)CC1.
What is the InChIKey of (4-methoxypiperazin-1-yl)-(1-methylcyclopropyl)methanone?
The InChIKey is ONSVFHGNLIWUBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2/c1-10(3-4-10)9(13)11-5-7-12(14-2)8-6-11/h3-8H2,1-2H3.
What are the key properties of (4-methoxypiperazin-1-yl)-(1-methylcyclopropyl)methanone?
(4-methoxypiperazin-1-yl)-(1-methylcyclopropyl)methanone has a molecular weight of 198.27 g/mol, XLogP of 0.49, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methoxypiperazin-1-yl)-(1-methylcyclopropyl)methanone is sourced from PubChem (CID 59857740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).