1-(4-methoxyphenyl)-3-[7-(4-methylpiperazin-1-yl)furo[2,3-c]pyridin-5-yl]imidazolidin-2-one

C22H25N5O3 — CID 53358565

IUPAC1-(4-methoxyphenyl)-3-[7-(4-methylpiperazin-1-yl)furo[2,3-c]pyridin-5-yl]imidazolidin-2-one
SMILESCOc1ccc(N2CCN(c3cc4ccoc4c(N4CCN(C)CC4)n3)C2=O)cc1
InChIInChI=1S/C22H25N5O3/c1-24-8-10-25(11-9-24)21-20-16(7-14-30-20)15-19(23-21)27-13-12-26(22(27)28)17-3-5-18(29-2)6-4-17/h3-7,14-15H,8-13H2,1-2H3
InChIKeyUIECNOXDIIGVRV-UHFFFAOYSA-N
MW407.47 g/mol
LogP3.03
Rot. Bonds4

About 1-(4-methoxyphenyl)-3-[7-(4-methylpiperazin-1-yl)furo[2,3-c]pyridin-5-yl]imidazolidin-2-one

1-(4-methoxyphenyl)-3-[7-(4-methylpiperazin-1-yl)furo[2,3-c]pyridin-5-yl]imidazolidin-2-one (PubChem CID 53358565) has the molecular formula C22H25N5O3 and a molecular weight of 407.47 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)-3-[7-(4-methylpiperazin-1-yl)furo[2,3-c]pyridin-5-yl]imidazolidin-2-one.

Molecular Properties

Compound Name1-(4-methoxyphenyl)-3-[7-(4-methylpiperazin-1-yl)furo[2,3-c]pyridin-5-yl]imidazolidin-2-one
PubChem CID53358565
Molecular FormulaC22H25N5O3
Molecular Weight407.47 g/mol
Exact Mass407.20
IUPAC Name1-(4-methoxyphenyl)-3-[7-(4-methylpiperazin-1-yl)furo[2,3-c]pyridin-5-yl]imidazolidin-2-one
SMILESCOc1ccc(N2CCN(c3cc4ccoc4c(N4CCN(C)CC4)n3)C2=O)cc1
InChIInChI=1S/C22H25N5O3/c1-24-8-10-25(11-9-24)21-20-16(7-14-30-20)15-19(23-21)27-13-12-26(22(27)28)17-3-5-18(29-2)6-4-17/h3-7,14-15H,8-13H2,1-2H3
InChIKeyUIECNOXDIIGVRV-UHFFFAOYSA-N
XLogP3.03
TPSA65.29 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500407.47
LogP ≤ 53.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)-3-[7-(4-methylpiperazin-1-yl)furo[2,3-c]pyridin-5-yl]imidazolidin-2-one?
The IUPAC name of 1-(4-methoxyphenyl)-3-[7-(4-methylpiperazin-1-yl)furo[2,3-c]pyridin-5-yl]imidazolidin-2-one (CID 53358565) is 1-(4-methoxyphenyl)-3-[7-(4-methylpiperazin-1-yl)furo[2,3-c]pyridin-5-yl]imidazolidin-2-one.
What is the SMILES notation for 1-(4-methoxyphenyl)-3-[7-(4-methylpiperazin-1-yl)furo[2,3-c]pyridin-5-yl]imidazolidin-2-one?
The canonical SMILES for 1-(4-methoxyphenyl)-3-[7-(4-methylpiperazin-1-yl)furo[2,3-c]pyridin-5-yl]imidazolidin-2-one is COc1ccc(N2CCN(c3cc4ccoc4c(N4CCN(C)CC4)n3)C2=O)cc1.
What is the InChIKey of 1-(4-methoxyphenyl)-3-[7-(4-methylpiperazin-1-yl)furo[2,3-c]pyridin-5-yl]imidazolidin-2-one?
The InChIKey is UIECNOXDIIGVRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N5O3/c1-24-8-10-25(11-9-24)21-20-16(7-14-30-20)15-19(23-21)27-13-12-26(22(27)28)17-3-5-18(29-2)6-4-17/h3-7,14-15H,8-13H2,1-2H3.
What are the key properties of 1-(4-methoxyphenyl)-3-[7-(4-methylpiperazin-1-yl)furo[2,3-c]pyridin-5-yl]imidazolidin-2-one?
1-(4-methoxyphenyl)-3-[7-(4-methylpiperazin-1-yl)furo[2,3-c]pyridin-5-yl]imidazolidin-2-one has a molecular weight of 407.47 g/mol, XLogP of 3.03, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)-3-[7-(4-methylpiperazin-1-yl)furo[2,3-c]pyridin-5-yl]imidazolidin-2-one is sourced from PubChem (CID 53358565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).