1-(furan-2-ylmethyl)-4-(3-phenylpropyl)piperazine

C18H24N2O — CID 740969

IUPAC1-(furan-2-ylmethyl)-4-(3-phenylpropyl)piperazine
SMILESc1ccc(CCCN2CCN(Cc3ccco3)CC2)cc1
InChIInChI=1S/C18H24N2O/c1-2-6-17(7-3-1)8-4-10-19-11-13-20(14-12-19)16-18-9-5-15-21-18/h1-3,5-7,9,15H,4,8,10-14,16H2
InChIKeyNRHGWLVPWBATRL-UHFFFAOYSA-N
MW284.40 g/mol
LogP3.03
Rot. Bonds6

About 1-(furan-2-ylmethyl)-4-(3-phenylpropyl)piperazine

1-(furan-2-ylmethyl)-4-(3-phenylpropyl)piperazine (PubChem CID 740969) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is 1-(furan-2-ylmethyl)-4-(3-phenylpropyl)piperazine.

Molecular Properties

Compound Name1-(furan-2-ylmethyl)-4-(3-phenylpropyl)piperazine
PubChem CID740969
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC Name1-(furan-2-ylmethyl)-4-(3-phenylpropyl)piperazine
SMILESc1ccc(CCCN2CCN(Cc3ccco3)CC2)cc1
InChIInChI=1S/C18H24N2O/c1-2-6-17(7-3-1)8-4-10-19-11-13-20(14-12-19)16-18-9-5-15-21-18/h1-3,5-7,9,15H,4,8,10-14,16H2
InChIKeyNRHGWLVPWBATRL-UHFFFAOYSA-N
XLogP3.03
TPSA19.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 53.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-[4-(furan-2-ylmethyl)piperazin-1-yl]propan-1-amine
CID 22689734
4-(furan-2-ylmethyl)-N-(3-phenylpropyl)piperazine-1-carboxamide
CID 113106387
1-[3-(furan-2-yl)propyl]piperidine
CID 162740839
1-(furan-2-ylmethyl)-4-methylpiperazine;methanamine
CID 162740974
N-(furan-2-ylmethyl)-1-(3-phenylpropyl)piperidin-3-amine
CID 45222723
4-[1-(furan-2-ylmethyl)piperidin-4-yl]-2-(3-phenylpropyl)morpholine
CID 45247185
1-(furan-2-ylmethyl)-4-[(4-methylphenyl)methyl]piperazine
CID 772071
1-(naphthalen-2-ylmethyl)-4-(3-phenylpropyl)piperazine
CID 59382224
3-[[4-(furan-2-ylmethyl)piperazin-1-yl]methyl]phenol
CID 166193246
(4-butylphenyl)-[4-(furan-2-ylmethyl)piperazin-1-yl]methanone
CID 17249343
2-[4-(furan-2-ylmethyl)piperazin-1-yl]aniline
CID 19626878
3-(furan-2-ylmethyl)-5-(2-phenylethyl)-1,3,5-thiadiazinane-2-thione
CID 23790438

Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-ylmethyl)-4-(3-phenylpropyl)piperazine?
The IUPAC name of 1-(furan-2-ylmethyl)-4-(3-phenylpropyl)piperazine (CID 740969) is 1-(furan-2-ylmethyl)-4-(3-phenylpropyl)piperazine.
What is the SMILES notation for 1-(furan-2-ylmethyl)-4-(3-phenylpropyl)piperazine?
The canonical SMILES for 1-(furan-2-ylmethyl)-4-(3-phenylpropyl)piperazine is c1ccc(CCCN2CCN(Cc3ccco3)CC2)cc1.
What is the InChIKey of 1-(furan-2-ylmethyl)-4-(3-phenylpropyl)piperazine?
The InChIKey is NRHGWLVPWBATRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-2-6-17(7-3-1)8-4-10-19-11-13-20(14-12-19)16-18-9-5-15-21-18/h1-3,5-7,9,15H,4,8,10-14,16H2.
What are the key properties of 1-(furan-2-ylmethyl)-4-(3-phenylpropyl)piperazine?
1-(furan-2-ylmethyl)-4-(3-phenylpropyl)piperazine has a molecular weight of 284.40 g/mol, XLogP of 3.03, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-ylmethyl)-4-(3-phenylpropyl)piperazine is sourced from PubChem (CID 740969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).