1-[1-[1-(6-methoxy-1H-indole-2-carbonyl)azetidin-3-yl]pyrazol-4-yl]imidazolidin-2-one

C19H20N6O3 — CID 126945631

IUPAC1-[1-[1-(6-methoxy-1H-indole-2-carbonyl)azetidin-3-yl]pyrazol-4-yl]imidazolidin-2-one
SMILESCOc1ccc2cc(C(=O)N3CC(n4cc(N5CCNC5=O)cn4)C3)[nH]c2c1
InChIInChI=1S/C19H20N6O3/c1-28-15-3-2-12-6-17(22-16(12)7-15)18(26)23-9-14(10-23)25-11-13(8-21-25)24-5-4-20-19(24)27/h2-3,6-8,11,14,22H,4-5,9-10H2,1H3,(H,20,27)
InChIKeyJQZUZYJDIFVXNA-UHFFFAOYSA-N
MW380.41 g/mol
LogP1.60
Rot. Bonds4

About 1-[1-[1-(6-methoxy-1H-indole-2-carbonyl)azetidin-3-yl]pyrazol-4-yl]imidazolidin-2-one

1-[1-[1-(6-methoxy-1H-indole-2-carbonyl)azetidin-3-yl]pyrazol-4-yl]imidazolidin-2-one (PubChem CID 126945631) has the molecular formula C19H20N6O3 and a molecular weight of 380.41 g/mol. Its IUPAC name is 1-[1-[1-(6-methoxy-1H-indole-2-carbonyl)azetidin-3-yl]pyrazol-4-yl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[1-[1-(6-methoxy-1H-indole-2-carbonyl)azetidin-3-yl]pyrazol-4-yl]imidazolidin-2-one
PubChem CID126945631
Molecular FormulaC19H20N6O3
Molecular Weight380.41 g/mol
Exact Mass380.16
IUPAC Name1-[1-[1-(6-methoxy-1H-indole-2-carbonyl)azetidin-3-yl]pyrazol-4-yl]imidazolidin-2-one
SMILESCOc1ccc2cc(C(=O)N3CC(n4cc(N5CCNC5=O)cn4)C3)[nH]c2c1
InChIInChI=1S/C19H20N6O3/c1-28-15-3-2-12-6-17(22-16(12)7-15)18(26)23-9-14(10-23)25-11-13(8-21-25)24-5-4-20-19(24)27/h2-3,6-8,11,14,22H,4-5,9-10H2,1H3,(H,20,27)
InChIKeyJQZUZYJDIFVXNA-UHFFFAOYSA-N
XLogP1.60
TPSA95.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.41
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-[1-[1-(6-methoxy-1H-indole-2-carbonyl)azetidin-3-yl]pyrazol-4-yl]-3-methylimidazolidin-2-one
CID 126945962
(6-methoxy-1H-indol-2-yl)-[3-(4-pyrimidin-2-ylpiperazin-1-yl)azetidin-1-yl]methanone
CID 126893730
1-[1-[1-(6-methoxyquinolin-4-yl)azetidin-3-yl]pyrazol-4-yl]imidazolidin-2-one
CID 126945708
(2,6-dimethylmorpholin-4-yl)-(6-methoxy-1H-indol-2-yl)methanone
CID 4870192
(6-methoxy-1H-indol-2-yl)-[4-(4-methoxyphenyl)piperazin-1-yl]methanone
CID 4909282
[3-[(5-chloro-2-pyridinyl)oxy]azetidin-1-yl]-(6-methoxy-1H-indol-2-yl)methanone
CID 122248470
4-[1-(6-methoxy-1H-indole-2-carbonyl)azetidin-3-yl]oxy-6-methylpyran-2-one
CID 121155632
1-[1-(1H-indole-2-carbonyl)azetidin-3-yl]pyrazole-4-carbonitrile
CID 126900479
(2R)-4-(6-methoxy-1H-indole-2-carbonyl)morpholine-2-carboxamide
CID 94825635
[3-(hydroxymethyl)-4-pyridin-2-ylpyrrolidin-1-yl]-(6-methoxy-1H-indol-2-yl)methanone
CID 156611412
[3-(4,6-dimethylpyrimidin-2-yl)oxypiperidin-1-yl]-(6-methoxy-1H-indol-2-yl)methanone
CID 122257934
3-[1-(6-methoxy-1H-indole-2-carbonyl)piperidin-3-yl]oxypyrazine-2-carbonitrile
CID 91628023

Frequently Asked Questions

What is the IUPAC name of 1-[1-[1-(6-methoxy-1H-indole-2-carbonyl)azetidin-3-yl]pyrazol-4-yl]imidazolidin-2-one?
The IUPAC name of 1-[1-[1-(6-methoxy-1H-indole-2-carbonyl)azetidin-3-yl]pyrazol-4-yl]imidazolidin-2-one (CID 126945631) is 1-[1-[1-(6-methoxy-1H-indole-2-carbonyl)azetidin-3-yl]pyrazol-4-yl]imidazolidin-2-one.
What is the SMILES notation for 1-[1-[1-(6-methoxy-1H-indole-2-carbonyl)azetidin-3-yl]pyrazol-4-yl]imidazolidin-2-one?
The canonical SMILES for 1-[1-[1-(6-methoxy-1H-indole-2-carbonyl)azetidin-3-yl]pyrazol-4-yl]imidazolidin-2-one is COc1ccc2cc(C(=O)N3CC(n4cc(N5CCNC5=O)cn4)C3)[nH]c2c1.
What is the InChIKey of 1-[1-[1-(6-methoxy-1H-indole-2-carbonyl)azetidin-3-yl]pyrazol-4-yl]imidazolidin-2-one?
The InChIKey is JQZUZYJDIFVXNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N6O3/c1-28-15-3-2-12-6-17(22-16(12)7-15)18(26)23-9-14(10-23)25-11-13(8-21-25)24-5-4-20-19(24)27/h2-3,6-8,11,14,22H,4-5,9-10H2,1H3,(H,20,27).
What are the key properties of 1-[1-[1-(6-methoxy-1H-indole-2-carbonyl)azetidin-3-yl]pyrazol-4-yl]imidazolidin-2-one?
1-[1-[1-(6-methoxy-1H-indole-2-carbonyl)azetidin-3-yl]pyrazol-4-yl]imidazolidin-2-one has a molecular weight of 380.41 g/mol, XLogP of 1.60, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[1-(6-methoxy-1H-indole-2-carbonyl)azetidin-3-yl]pyrazol-4-yl]imidazolidin-2-one is sourced from PubChem (CID 126945631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).