1-(furan-3-yl)-4-methylpiperazine

C9H14N2O — CID 173103477

IUPAC1-(furan-3-yl)-4-methylpiperazine
SMILESCN1CCN(c2ccoc2)CC1
InChIInChI=1S/C9H14N2O/c1-10-3-5-11(6-4-10)9-2-7-12-8-9/h2,7-8H,3-6H2,1H3
InChIKeyLFVHMSPOYGGCEA-UHFFFAOYSA-N
MW166.22 g/mol
LogP1.03
Rot. Bonds1

About 1-(furan-3-yl)-4-methylpiperazine

1-(furan-3-yl)-4-methylpiperazine (PubChem CID 173103477) has the molecular formula C9H14N2O and a molecular weight of 166.22 g/mol. Its IUPAC name is 1-(furan-3-yl)-4-methylpiperazine.

Molecular Properties

Compound Name1-(furan-3-yl)-4-methylpiperazine
PubChem CID173103477
Molecular FormulaC9H14N2O
Molecular Weight166.22 g/mol
Exact Mass166.11
IUPAC Name1-(furan-3-yl)-4-methylpiperazine
SMILESCN1CCN(c2ccoc2)CC1
InChIInChI=1S/C9H14N2O/c1-10-3-5-11(6-4-10)9-2-7-12-8-9/h2,7-8H,3-6H2,1H3
InChIKeyLFVHMSPOYGGCEA-UHFFFAOYSA-N
XLogP1.03
TPSA19.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.22
LogP ≤ 51.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

Ammonium, (3-furyl)trimethyl-, iodide
CID 199990
4-(Furan-3-yl)morpholine
CID 12009355
Furan-3-yl(trimethyl)azanium
CID 199991
N-(2-fluoroethyl)furan-3-amine
CID 140143628
4,4-Difluoro-1-(furan-3-yl)piperidine
CID 175988490
ethyl N-(2-bromoprop-2-enyl)-N-(furan-3-yl)carbamate
CID 135076654
N,N-diethylfuran-3-amine
CID 12009356
N-butylfuran-3-amine
CID 12009357
1-(Furan-3-yl)pyrrolidine
CID 18364766
1-(Furan-3-yl)pyridin-4-one
CID 19788565
1-(Furan-3-yl)azetidin-2-one
CID 19802974
alpha-(3-Furyl)aminoacetonitrile
CID 19891029

Frequently Asked Questions

What is the IUPAC name of 1-(furan-3-yl)-4-methylpiperazine?
The IUPAC name of 1-(furan-3-yl)-4-methylpiperazine (CID 173103477) is 1-(furan-3-yl)-4-methylpiperazine.
What is the SMILES notation for 1-(furan-3-yl)-4-methylpiperazine?
The canonical SMILES for 1-(furan-3-yl)-4-methylpiperazine is CN1CCN(c2ccoc2)CC1.
What is the InChIKey of 1-(furan-3-yl)-4-methylpiperazine?
The InChIKey is LFVHMSPOYGGCEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O/c1-10-3-5-11(6-4-10)9-2-7-12-8-9/h2,7-8H,3-6H2,1H3.
What are the key properties of 1-(furan-3-yl)-4-methylpiperazine?
1-(furan-3-yl)-4-methylpiperazine has a molecular weight of 166.22 g/mol, XLogP of 1.03, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-3-yl)-4-methylpiperazine is sourced from PubChem (CID 173103477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).