[5-(2-chlorophenyl)furan-2-yl]-[2-(1-methylimidazol-2-yl)piperazin-1-yl]methanone

C19H19ClN4O2 — CID 120878800

IUPAC[5-(2-chlorophenyl)furan-2-yl]-[2-(1-methylimidazol-2-yl)piperazin-1-yl]methanone
SMILESCn1ccnc1C1CNCCN1C(=O)c1ccc(-c2ccccc2Cl)o1
InChIInChI=1S/C19H19ClN4O2/c1-23-10-9-22-18(23)15-12-21-8-11-24(15)19(25)17-7-6-16(26-17)13-4-2-3-5-14(13)20/h2-7,9-10,15,21H,8,11-12H2,1H3
InChIKeyHLQKNTTUIZYLMA-UHFFFAOYSA-N
MW370.84 g/mol
LogP3.12
Rot. Bonds3

About [5-(2-chlorophenyl)furan-2-yl]-[2-(1-methylimidazol-2-yl)piperazin-1-yl]methanone

[5-(2-chlorophenyl)furan-2-yl]-[2-(1-methylimidazol-2-yl)piperazin-1-yl]methanone (PubChem CID 120878800) has the molecular formula C19H19ClN4O2 and a molecular weight of 370.84 g/mol. Its IUPAC name is [5-(2-chlorophenyl)furan-2-yl]-[2-(1-methylimidazol-2-yl)piperazin-1-yl]methanone.

Molecular Properties

Compound Name[5-(2-chlorophenyl)furan-2-yl]-[2-(1-methylimidazol-2-yl)piperazin-1-yl]methanone
PubChem CID120878800
Molecular FormulaC19H19ClN4O2
Molecular Weight370.84 g/mol
Exact Mass370.12
IUPAC Name[5-(2-chlorophenyl)furan-2-yl]-[2-(1-methylimidazol-2-yl)piperazin-1-yl]methanone
SMILESCn1ccnc1C1CNCCN1C(=O)c1ccc(-c2ccccc2Cl)o1
InChIInChI=1S/C19H19ClN4O2/c1-23-10-9-22-18(23)15-12-21-8-11-24(15)19(25)17-7-6-16(26-17)13-4-2-3-5-14(13)20/h2-7,9-10,15,21H,8,11-12H2,1H3
InChIKeyHLQKNTTUIZYLMA-UHFFFAOYSA-N
XLogP3.12
TPSA63.30 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.84
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(5-methylfuran-2-yl)-[2-(1-methylimidazol-2-yl)piperazin-1-yl]methanone
CID 120878370
[2-(1-methylimidazol-2-yl)piperazin-1-yl]-(5-methylsulfanylfuran-2-yl)methanone;hydrochloride
CID 120879171
[5-(1,3-benzothiazol-2-yl)furan-2-yl]-[2-(1-methylimidazol-2-yl)piperazin-1-yl]methanone;dihydrochloride
CID 120878469
1-benzofuran-2-yl-[2-(1-methylimidazol-2-yl)piperazin-1-yl]methanone;hydrochloride
CID 120877663
[2-(1-methylimidazol-2-yl)piperazin-1-yl]-(3-pyridin-2-yl-1,2-oxazol-5-yl)methanone
CID 120879950
(3,5-dichlorophenyl)-[2-(1-methylimidazol-2-yl)piperazin-1-yl]methanone
CID 120880230
[2-(1-methylimidazol-2-yl)piperazin-1-yl]-(1-methylpyrrol-2-yl)methanone;hydrochloride
CID 120879273
2-(2,6-dichlorophenyl)-1-[2-(1-methylimidazol-2-yl)piperazin-1-yl]ethanone;hydrochloride
CID 120880473
(2-chloro-4,5-difluorophenyl)-[2-(1-methylimidazol-2-yl)piperazin-1-yl]methanone;hydrochloride
CID 120878629
[2-(1-methylimidazol-2-yl)piperazin-1-yl]-(4-methylphenyl)methanone
CID 120878912
[2-(1-methylimidazol-2-yl)piperazin-1-yl]-(1H-pyrrol-2-yl)methanone;hydrochloride
CID 120878125
(5-chloro-1-phenylpyrazol-4-yl)-[2-(1-methylimidazol-2-yl)piperazin-1-yl]methanone
CID 166261409

Frequently Asked Questions

What is the IUPAC name of [5-(2-chlorophenyl)furan-2-yl]-[2-(1-methylimidazol-2-yl)piperazin-1-yl]methanone?
The IUPAC name of [5-(2-chlorophenyl)furan-2-yl]-[2-(1-methylimidazol-2-yl)piperazin-1-yl]methanone (CID 120878800) is [5-(2-chlorophenyl)furan-2-yl]-[2-(1-methylimidazol-2-yl)piperazin-1-yl]methanone.
What is the SMILES notation for [5-(2-chlorophenyl)furan-2-yl]-[2-(1-methylimidazol-2-yl)piperazin-1-yl]methanone?
The canonical SMILES for [5-(2-chlorophenyl)furan-2-yl]-[2-(1-methylimidazol-2-yl)piperazin-1-yl]methanone is Cn1ccnc1C1CNCCN1C(=O)c1ccc(-c2ccccc2Cl)o1.
What is the InChIKey of [5-(2-chlorophenyl)furan-2-yl]-[2-(1-methylimidazol-2-yl)piperazin-1-yl]methanone?
The InChIKey is HLQKNTTUIZYLMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19ClN4O2/c1-23-10-9-22-18(23)15-12-21-8-11-24(15)19(25)17-7-6-16(26-17)13-4-2-3-5-14(13)20/h2-7,9-10,15,21H,8,11-12H2,1H3.
What are the key properties of [5-(2-chlorophenyl)furan-2-yl]-[2-(1-methylimidazol-2-yl)piperazin-1-yl]methanone?
[5-(2-chlorophenyl)furan-2-yl]-[2-(1-methylimidazol-2-yl)piperazin-1-yl]methanone has a molecular weight of 370.84 g/mol, XLogP of 3.12, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(2-chlorophenyl)furan-2-yl]-[2-(1-methylimidazol-2-yl)piperazin-1-yl]methanone is sourced from PubChem (CID 120878800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).