3-(2-phenyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)-1-piperazin-1-ylpropan-1-one;hydrochloride

C20H26ClN3O2 — CID 120982121

IUPAC3-(2-phenyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)-1-piperazin-1-ylpropan-1-one;hydrochloride
SMILESCl.O=C(CCN1CCc2cc(-c3ccccc3)oc2C1)N1CCNCC1
InChIInChI=1S/C20H25N3O2.ClH/c24-20(23-12-8-21-9-13-23)7-11-22-10-6-17-14-18(25-19(17)15-22)16-4-2-1-3-5-16;/h1-5,14,21H,6-13,15H2;1H
InChIKeySLJCUWQMHXHOQK-UHFFFAOYSA-N
MW375.90 g/mol
LogP2.55
Rot. Bonds4

About 3-(2-phenyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)-1-piperazin-1-ylpropan-1-one;hydrochloride

3-(2-phenyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)-1-piperazin-1-ylpropan-1-one;hydrochloride (PubChem CID 120982121) has the molecular formula C20H26ClN3O2 and a molecular weight of 375.90 g/mol. Its IUPAC name is 3-(2-phenyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)-1-piperazin-1-ylpropan-1-one;hydrochloride.

Molecular Properties

Compound Name3-(2-phenyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)-1-piperazin-1-ylpropan-1-one;hydrochloride
PubChem CID120982121
Molecular FormulaC20H26ClN3O2
Molecular Weight375.90 g/mol
Exact Mass375.17
IUPAC Name3-(2-phenyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)-1-piperazin-1-ylpropan-1-one;hydrochloride
SMILESCl.O=C(CCN1CCc2cc(-c3ccccc3)oc2C1)N1CCNCC1
InChIInChI=1S/C20H25N3O2.ClH/c24-20(23-12-8-21-9-13-23)7-11-22-10-6-17-14-18(25-19(17)15-22)16-4-2-1-3-5-16;/h1-5,14,21H,6-13,15H2;1H
InChIKeySLJCUWQMHXHOQK-UHFFFAOYSA-N
XLogP2.55
TPSA48.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.90
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(2-phenyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)-1-piperazin-1-ylpropan-1-one;hydrochloride 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

4-(2-phenyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)butan-1-ol
CID 111630024
3-(4-benzylpiperazin-1-yl)-1-piperazin-1-ylpropan-1-one;dihydrochloride
CID 120982250
3-(3,4-dihydro-1H-isoquinolin-2-yl)-1-morpholin-4-ylpropan-1-one
CID 109015672
2-chloro-1-(2-phenyl-6,7-dihydro-4H-furo[3,2-c]pyridin-5-yl)ethanone
CID 166408897
3-(3,4-dihydro-1H-isoquinolin-2-yl)-1-(4-methylpiperazin-1-yl)propan-1-one
CID 109017206
3-(6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)-1-piperazin-1-ylpropan-1-one;hydrochloride
CID 120981584
3-[4-(2-phenylethyl)piperazin-1-yl]-1-piperazin-1-ylpropan-1-one
CID 120982352
1-(1,4-diazepan-1-yl)-3-(4-phenylpiperazin-1-yl)propan-1-one
CID 119418032
(2-phenyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)-(2-sulfanylidene-1H-pyridin-3-yl)methanone
CID 91643821
4-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propanoyl]piperazine-1-carbaldehyde
CID 109017784
4-(2-phenyl-5,7-dihydro-4H-furo[2,3-c]pyridine-6-carbonyl)-2H-phthalazin-1-one
CID 124609450
3-(3,4-dihydro-1H-isoquinolin-2-yl)-1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)propan-1-one
CID 109024540

Frequently Asked Questions

What is the IUPAC name of 3-(2-phenyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)-1-piperazin-1-ylpropan-1-one;hydrochloride?
The IUPAC name of 3-(2-phenyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)-1-piperazin-1-ylpropan-1-one;hydrochloride (CID 120982121) is 3-(2-phenyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)-1-piperazin-1-ylpropan-1-one;hydrochloride.
What is the SMILES notation for 3-(2-phenyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)-1-piperazin-1-ylpropan-1-one;hydrochloride?
The canonical SMILES for 3-(2-phenyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)-1-piperazin-1-ylpropan-1-one;hydrochloride is Cl.O=C(CCN1CCc2cc(-c3ccccc3)oc2C1)N1CCNCC1.
What is the InChIKey of 3-(2-phenyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)-1-piperazin-1-ylpropan-1-one;hydrochloride?
The InChIKey is SLJCUWQMHXHOQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O2.ClH/c24-20(23-12-8-21-9-13-23)7-11-22-10-6-17-14-18(25-19(17)15-22)16-4-2-1-3-5-16;/h1-5,14,21H,6-13,15H2;1H.
What are the key properties of 3-(2-phenyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)-1-piperazin-1-ylpropan-1-one;hydrochloride?
3-(2-phenyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)-1-piperazin-1-ylpropan-1-one;hydrochloride has a molecular weight of 375.90 g/mol, XLogP of 2.55, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-phenyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)-1-piperazin-1-ylpropan-1-one;hydrochloride is sourced from PubChem (CID 120982121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).