3-(4-tert-butylphenyl)-5-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]furo[3,2-b]pyridine

C26H30N4O2 — CID 162672428

IUPAC3-(4-tert-butylphenyl)-5-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]furo[3,2-b]pyridine
SMILESCC(C)(C)c1ccc(-c2coc3ccc(-c4cnn(CCN5CCOCC5)c4)nc23)cc1
InChIInChI=1S/C26H30N4O2/c1-26(2,3)21-6-4-19(5-7-21)22-18-32-24-9-8-23(28-25(22)24)20-16-27-30(17-20)11-10-29-12-14-31-15-13-29/h4-9,16-18H,10-15H2,1-3H3
InChIKeyKYWPMQJAUGPHCO-UHFFFAOYSA-N
MW430.55 g/mol
LogP4.99
Rot. Bonds5

About 3-(4-tert-butylphenyl)-5-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]furo[3,2-b]pyridine

3-(4-tert-butylphenyl)-5-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]furo[3,2-b]pyridine (PubChem CID 162672428) has the molecular formula C26H30N4O2 and a molecular weight of 430.55 g/mol. Its IUPAC name is 3-(4-tert-butylphenyl)-5-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]furo[3,2-b]pyridine.

Molecular Properties

Compound Name3-(4-tert-butylphenyl)-5-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]furo[3,2-b]pyridine
PubChem CID162672428
Molecular FormulaC26H30N4O2
Molecular Weight430.55 g/mol
Exact Mass430.24
IUPAC Name3-(4-tert-butylphenyl)-5-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]furo[3,2-b]pyridine
SMILESCC(C)(C)c1ccc(-c2coc3ccc(-c4cnn(CCN5CCOCC5)c4)nc23)cc1
InChIInChI=1S/C26H30N4O2/c1-26(2,3)21-6-4-19(5-7-21)22-18-32-24-9-8-23(28-25(22)24)20-16-27-30(17-20)11-10-29-12-14-31-15-13-29/h4-9,16-18H,10-15H2,1-3H3
InChIKeyKYWPMQJAUGPHCO-UHFFFAOYSA-N
XLogP4.99
TPSA56.32 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500430.55
LogP ≤ 54.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 3-(4-tert-butylphenyl)-5-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]furo[3,2-b]pyridine with MolForge

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Related Compounds

3-(1-benzylpyrazol-4-yl)-5-(1-methylpyrazol-4-yl)furo[3,2-b]pyridine
CID 135567465
N-methyl-6-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]pyrimidin-4-amine
CID 141200703
5-(1-methylpyrazol-4-yl)-3-[3-(1H-pyrazol-4-yl)phenyl]furo[3,2-b]pyridine
CID 162669205
4-[2-[4-(4-methyl-3-morpholin-4-ylsulfonylphenyl)pyrazol-1-yl]ethyl]morpholine
CID 171431398
4-[2-[4-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-4-yl]pyrazol-1-yl]ethyl]morpholine
CID 167366502
4-[3-(4-pyridin-3-ylpyrazol-1-yl)propyl]morpholine
CID 141300555
4-[6-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]pyrimidin-4-yl]oxyaniline
CID 58917079
N-[(1R)-1-(1-benzofuran-2-yl)ethyl]-1-(2-morpholin-4-ylethyl)pyrazol-4-amine
CID 99781367
4-(4-tert-butylphenyl)-1-ethylpyrazole
CID 126653145
8-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]-3H-pyrido[3,4-d]pyrimidin-4-one
CID 137053176
8-[1-(2-hydroxyethyl)pyrazol-4-yl]-3-methyl-1-(oxan-4-yl)imidazo[4,5-c][1,5]naphthyridin-2-one
CID 58379642
4-methyl-N-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]benzamide
CID 121419957

Frequently Asked Questions

What is the IUPAC name of 3-(4-tert-butylphenyl)-5-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]furo[3,2-b]pyridine?
The IUPAC name of 3-(4-tert-butylphenyl)-5-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]furo[3,2-b]pyridine (CID 162672428) is 3-(4-tert-butylphenyl)-5-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]furo[3,2-b]pyridine.
What is the SMILES notation for 3-(4-tert-butylphenyl)-5-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]furo[3,2-b]pyridine?
The canonical SMILES for 3-(4-tert-butylphenyl)-5-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]furo[3,2-b]pyridine is CC(C)(C)c1ccc(-c2coc3ccc(-c4cnn(CCN5CCOCC5)c4)nc23)cc1.
What is the InChIKey of 3-(4-tert-butylphenyl)-5-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]furo[3,2-b]pyridine?
The InChIKey is KYWPMQJAUGPHCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H30N4O2/c1-26(2,3)21-6-4-19(5-7-21)22-18-32-24-9-8-23(28-25(22)24)20-16-27-30(17-20)11-10-29-12-14-31-15-13-29/h4-9,16-18H,10-15H2,1-3H3.
What are the key properties of 3-(4-tert-butylphenyl)-5-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]furo[3,2-b]pyridine?
3-(4-tert-butylphenyl)-5-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]furo[3,2-b]pyridine has a molecular weight of 430.55 g/mol, XLogP of 4.99, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-tert-butylphenyl)-5-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]furo[3,2-b]pyridine is sourced from PubChem (CID 162672428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).