4-[2-[4-(1-phenylpyrazol-4-yl)quinolin-7-yl]oxyethyl]morpholine

C24H24N4O2 — CID 70683517

IUPAC4-[2-[4-(1-phenylpyrazol-4-yl)quinolin-7-yl]oxyethyl]morpholine
SMILESc1ccc(-n2cc(-c3ccnc4cc(OCCN5CCOCC5)ccc34)cn2)cc1
InChIInChI=1S/C24H24N4O2/c1-2-4-20(5-3-1)28-18-19(17-26-28)22-8-9-25-24-16-21(6-7-23(22)24)30-15-12-27-10-13-29-14-11-27/h1-9,16-18H,10-15H2
InChIKeyBXCQZSGOHLPFBD-UHFFFAOYSA-N
MW400.48 g/mol
LogP3.80
Rot. Bonds6

About 4-[2-[4-(1-phenylpyrazol-4-yl)quinolin-7-yl]oxyethyl]morpholine

4-[2-[4-(1-phenylpyrazol-4-yl)quinolin-7-yl]oxyethyl]morpholine (PubChem CID 70683517) has the molecular formula C24H24N4O2 and a molecular weight of 400.48 g/mol. Its IUPAC name is 4-[2-[4-(1-phenylpyrazol-4-yl)quinolin-7-yl]oxyethyl]morpholine.

Molecular Properties

Compound Name4-[2-[4-(1-phenylpyrazol-4-yl)quinolin-7-yl]oxyethyl]morpholine
PubChem CID70683517
Molecular FormulaC24H24N4O2
Molecular Weight400.48 g/mol
Exact Mass400.19
IUPAC Name4-[2-[4-(1-phenylpyrazol-4-yl)quinolin-7-yl]oxyethyl]morpholine
SMILESc1ccc(-n2cc(-c3ccnc4cc(OCCN5CCOCC5)ccc34)cn2)cc1
InChIInChI=1S/C24H24N4O2/c1-2-4-20(5-3-1)28-18-19(17-26-28)22-8-9-25-24-16-21(6-7-23(22)24)30-15-12-27-10-13-29-14-11-27/h1-9,16-18H,10-15H2
InChIKeyBXCQZSGOHLPFBD-UHFFFAOYSA-N
XLogP3.80
TPSA52.41 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.48
LogP ≤ 53.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

1-[4-[2-[4-(1-phenylpyrazol-4-yl)quinolin-7-yl]oxyethyl]piperazin-1-yl]ethanone
CID 70683518
[4-(1-phenylpyrazol-4-yl)quinolin-7-yl] N,N-dimethylcarbamate
CID 70683529
4-[2-[6-(4-pyridin-4-ylpyrazol-1-yl)naphthalen-2-yl]oxyethyl]morpholine;bis(2,2,2-trifluoroacetic acid)
CID 53393104
1-phenyl-4-(2-pyrrolidin-1-ylethoxy)pyrazole
CID 117234134
4-[2-[4-(4-chlorophenyl)-1-phenylpyrazol-3-yl]oxyethyl]morpholine
CID 3047072
7-(2-morpholin-4-ylethoxy)-2-phenylchromen-4-one
CID 162359717
4-[3-[4-(1-hydroxyindol-3-yl)quinazolin-7-yl]oxypropyl]morpholine
CID 139836432
4-[2-[4-[(3S,3aS)-2-pyridin-2-yl-3a,4,5,6-tetrahydro-3H-pyrrolo[1,2-b]pyrazol-3-yl]quinolin-7-yl]oxyethyl]morpholine
CID 129373489
5-(2-morpholin-4-ylethoxy)-3-phenyl-2-pyridin-3-ylinden-1-one
CID 51002145
5-(2-morpholin-4-ylethoxy)-3-phenyl-2-pyridin-4-ylinden-1-one
CID 51002189
1-[3-(2-morpholin-4-ylethoxy)phenyl]-3-phenylpyrazol-5-amine
CID 161408608
4-[1-(3-methoxyphenyl)pyrazol-4-yl]-N-(3-morpholin-4-ylpropyl)pyrimidin-2-amine
CID 129071969

Frequently Asked Questions

What is the IUPAC name of 4-[2-[4-(1-phenylpyrazol-4-yl)quinolin-7-yl]oxyethyl]morpholine?
The IUPAC name of 4-[2-[4-(1-phenylpyrazol-4-yl)quinolin-7-yl]oxyethyl]morpholine (CID 70683517) is 4-[2-[4-(1-phenylpyrazol-4-yl)quinolin-7-yl]oxyethyl]morpholine.
What is the SMILES notation for 4-[2-[4-(1-phenylpyrazol-4-yl)quinolin-7-yl]oxyethyl]morpholine?
The canonical SMILES for 4-[2-[4-(1-phenylpyrazol-4-yl)quinolin-7-yl]oxyethyl]morpholine is c1ccc(-n2cc(-c3ccnc4cc(OCCN5CCOCC5)ccc34)cn2)cc1.
What is the InChIKey of 4-[2-[4-(1-phenylpyrazol-4-yl)quinolin-7-yl]oxyethyl]morpholine?
The InChIKey is BXCQZSGOHLPFBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N4O2/c1-2-4-20(5-3-1)28-18-19(17-26-28)22-8-9-25-24-16-21(6-7-23(22)24)30-15-12-27-10-13-29-14-11-27/h1-9,16-18H,10-15H2.
What are the key properties of 4-[2-[4-(1-phenylpyrazol-4-yl)quinolin-7-yl]oxyethyl]morpholine?
4-[2-[4-(1-phenylpyrazol-4-yl)quinolin-7-yl]oxyethyl]morpholine has a molecular weight of 400.48 g/mol, XLogP of 3.80, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[4-(1-phenylpyrazol-4-yl)quinolin-7-yl]oxyethyl]morpholine is sourced from PubChem (CID 70683517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).