1-(4-chlorophenyl)-3-[5-methoxy-6-(4-methylpiperazin-1-yl)-2-pyridinyl]imidazolidin-2-one

C20H24ClN5O2 — CID 53358810

IUPAC1-(4-chlorophenyl)-3-[5-methoxy-6-(4-methylpiperazin-1-yl)-2-pyridinyl]imidazolidin-2-one
SMILESCOc1ccc(N2CCN(c3ccc(Cl)cc3)C2=O)nc1N1CCN(C)CC1
InChIInChI=1S/C20H24ClN5O2/c1-23-9-11-24(12-10-23)19-17(28-2)7-8-18(22-19)26-14-13-25(20(26)27)16-5-3-15(21)4-6-16/h3-8H,9-14H2,1-2H3
InChIKeyRFVULXIUFQAQNW-UHFFFAOYSA-N
MW401.90 g/mol
LogP2.94
Rot. Bonds4

About 1-(4-chlorophenyl)-3-[5-methoxy-6-(4-methylpiperazin-1-yl)-2-pyridinyl]imidazolidin-2-one

1-(4-chlorophenyl)-3-[5-methoxy-6-(4-methylpiperazin-1-yl)-2-pyridinyl]imidazolidin-2-one (PubChem CID 53358810) has the molecular formula C20H24ClN5O2 and a molecular weight of 401.90 g/mol. Its IUPAC name is 1-(4-chlorophenyl)-3-[5-methoxy-6-(4-methylpiperazin-1-yl)-2-pyridinyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-(4-chlorophenyl)-3-[5-methoxy-6-(4-methylpiperazin-1-yl)-2-pyridinyl]imidazolidin-2-one
PubChem CID53358810
Molecular FormulaC20H24ClN5O2
Molecular Weight401.90 g/mol
Exact Mass401.16
IUPAC Name1-(4-chlorophenyl)-3-[5-methoxy-6-(4-methylpiperazin-1-yl)-2-pyridinyl]imidazolidin-2-one
SMILESCOc1ccc(N2CCN(c3ccc(Cl)cc3)C2=O)nc1N1CCN(C)CC1
InChIInChI=1S/C20H24ClN5O2/c1-23-9-11-24(12-10-23)19-17(28-2)7-8-18(22-19)26-14-13-25(20(26)27)16-5-3-15(21)4-6-16/h3-8H,9-14H2,1-2H3
InChIKeyRFVULXIUFQAQNW-UHFFFAOYSA-N
XLogP2.94
TPSA52.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500401.90
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 1-(4-chlorophenyl)-3-[5-methoxy-6-(4-methylpiperazin-1-yl)-2-pyridinyl]imidazolidin-2-one with MolForge

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Related Compounds

1-[5-methoxy-6-(4-methylpiperazin-1-yl)-2-pyridinyl]-3-phenylimidazolidin-2-one
CID 53358683
1-(4-chlorophenyl)-3-[7-(4-methylpiperazin-1-yl)furo[2,3-c]pyridin-5-yl]imidazolidin-2-one
CID 53358680
1-(4-methoxyphenyl)-3-[7-(4-methylpiperazin-1-yl)furo[2,3-c]pyridin-5-yl]imidazolidin-2-one
CID 53358565
4-(5-chloro-2-methoxyphenyl)-6-(4-methylpiperazin-1-yl)pyrimidin-2-amine
CID 74249552
4-[(4-chlorophenyl)methoxy]-3-methoxy-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]benzamide
CID 25396665
1-(5-chloro-3-methoxy-2-pyridinyl)-4-methylpiperazine
CID 138561291
2-chloro-5-(4-chlorophenoxy)-4-(4-methylpiperazin-1-yl)pyrimidine
CID 18432576
1-(3,4-dimethoxyphenyl)-4-methylpiperazine
CID 21363782
N-(5-chloro-2-methoxyphenyl)-4-(4-methylpiperazin-1-yl)pyrimidin-2-amine
CID 112888006
1-(4-chloro-3-methoxyphenyl)-4-methylpiperazine
CID 143061679
2-[4-(4-chlorophenyl)piperazin-1-yl]-4,7-dimethoxy-1,3-benzothiazole
CID 121081719
4-[(4-chlorophenyl)methoxy]-3-methoxy-N-[[4-(4-methylpiperazin-1-yl)phenyl]carbamothioyl]benzamide
CID 3553455

Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)-3-[5-methoxy-6-(4-methylpiperazin-1-yl)-2-pyridinyl]imidazolidin-2-one?
The IUPAC name of 1-(4-chlorophenyl)-3-[5-methoxy-6-(4-methylpiperazin-1-yl)-2-pyridinyl]imidazolidin-2-one (CID 53358810) is 1-(4-chlorophenyl)-3-[5-methoxy-6-(4-methylpiperazin-1-yl)-2-pyridinyl]imidazolidin-2-one.
What is the SMILES notation for 1-(4-chlorophenyl)-3-[5-methoxy-6-(4-methylpiperazin-1-yl)-2-pyridinyl]imidazolidin-2-one?
The canonical SMILES for 1-(4-chlorophenyl)-3-[5-methoxy-6-(4-methylpiperazin-1-yl)-2-pyridinyl]imidazolidin-2-one is COc1ccc(N2CCN(c3ccc(Cl)cc3)C2=O)nc1N1CCN(C)CC1.
What is the InChIKey of 1-(4-chlorophenyl)-3-[5-methoxy-6-(4-methylpiperazin-1-yl)-2-pyridinyl]imidazolidin-2-one?
The InChIKey is RFVULXIUFQAQNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24ClN5O2/c1-23-9-11-24(12-10-23)19-17(28-2)7-8-18(22-19)26-14-13-25(20(26)27)16-5-3-15(21)4-6-16/h3-8H,9-14H2,1-2H3.
What are the key properties of 1-(4-chlorophenyl)-3-[5-methoxy-6-(4-methylpiperazin-1-yl)-2-pyridinyl]imidazolidin-2-one?
1-(4-chlorophenyl)-3-[5-methoxy-6-(4-methylpiperazin-1-yl)-2-pyridinyl]imidazolidin-2-one has a molecular weight of 401.90 g/mol, XLogP of 2.94, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)-3-[5-methoxy-6-(4-methylpiperazin-1-yl)-2-pyridinyl]imidazolidin-2-one is sourced from PubChem (CID 53358810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).