3-[4-[methyl(2-morpholin-4-ylethyl)amino]-2-piperidin-1-ylphenyl]-5-(1H-pyrazol-4-yl)furan-2-carboxamide

C26H34N6O3 — CID 175918869

IUPAC3-[4-[methyl(2-morpholin-4-ylethyl)amino]-2-piperidin-1-ylphenyl]-5-(1H-pyrazol-4-yl)furan-2-carboxamide
SMILESCN(CCN1CCOCC1)c1ccc(-c2cc(-c3cn[nH]c3)oc2C(N)=O)c(N2CCCCC2)c1
InChIInChI=1S/C26H34N6O3/c1-30(9-10-31-11-13-34-14-12-31)20-5-6-21(23(15-20)32-7-3-2-4-8-32)22-16-24(19-17-28-29-18-19)35-25(22)26(27)33/h5-6,15-18H,2-4,7-14H2,1H3,(H2,27,33)(H,28,29)
InChIKeyFGWKFFZIQOBCJT-UHFFFAOYSA-N
MW478.60 g/mol
LogP3.19
Rot. Bonds8

About 3-[4-[methyl(2-morpholin-4-ylethyl)amino]-2-piperidin-1-ylphenyl]-5-(1H-pyrazol-4-yl)furan-2-carboxamide

3-[4-[methyl(2-morpholin-4-ylethyl)amino]-2-piperidin-1-ylphenyl]-5-(1H-pyrazol-4-yl)furan-2-carboxamide (PubChem CID 175918869) has the molecular formula C26H34N6O3 and a molecular weight of 478.60 g/mol. Its IUPAC name is 3-[4-[methyl(2-morpholin-4-ylethyl)amino]-2-piperidin-1-ylphenyl]-5-(1H-pyrazol-4-yl)furan-2-carboxamide.

Molecular Properties

Compound Name3-[4-[methyl(2-morpholin-4-ylethyl)amino]-2-piperidin-1-ylphenyl]-5-(1H-pyrazol-4-yl)furan-2-carboxamide
PubChem CID175918869
Molecular FormulaC26H34N6O3
Molecular Weight478.60 g/mol
Exact Mass478.27
IUPAC Name3-[4-[methyl(2-morpholin-4-ylethyl)amino]-2-piperidin-1-ylphenyl]-5-(1H-pyrazol-4-yl)furan-2-carboxamide
SMILESCN(CCN1CCOCC1)c1ccc(-c2cc(-c3cn[nH]c3)oc2C(N)=O)c(N2CCCCC2)c1
InChIInChI=1S/C26H34N6O3/c1-30(9-10-31-11-13-34-14-12-31)20-5-6-21(23(15-20)32-7-3-2-4-8-32)22-16-24(19-17-28-29-18-19)35-25(22)26(27)33/h5-6,15-18H,2-4,7-14H2,1H3,(H2,27,33)(H,28,29)
InChIKeyFGWKFFZIQOBCJT-UHFFFAOYSA-N
XLogP3.19
TPSA103.86 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500478.60
LogP ≤ 53.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 3-[4-[methyl(2-morpholin-4-ylethyl)amino]-2-piperidin-1-ylphenyl]-5-(1H-pyrazol-4-yl)furan-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[5-(morpholin-4-ylmethyl)-2-piperidin-1-ylphenyl]-5-(1H-pyrazol-4-yl)furan-2-carboxamide
CID 137370580
3-[4-(4-methylpiperazin-1-yl)-2-piperidin-1-ylphenyl]-6-(1H-pyrazol-4-yl)pyridine-2-carboxamide
CID 175918801
5-[5-(2-morpholin-4-yl-2-oxoethyl)-2-piperidin-1-ylphenyl]-2-(1H-pyrazol-4-yl)-1,3-thiazole-4-carboxamide
CID 175918837
[4-(1H-pyrazol-4-yl)phenyl]-(2-pyrrolidin-1-ylethyl)carbamic acid
CID 91523495
N-(6-morpholin-4-yl-4-piperidin-1-yl-3-pyridinyl)-5-(1H-pyrazol-4-yl)furan-2-carboxamide
CID 137370804
N-[4-(2-morpholin-4-ylethylamino)-2-piperidin-1-ylphenyl]-2-(1H-pyrazol-4-yl)-1,3-thiazole-4-carboxamide
CID 137370909
4-tert-butyl-N-methyl-N-(2-morpholin-4-ylethyl)aniline
CID 158025581
[6-[methyl(2-morpholin-4-ylethyl)amino]pyrazin-2-yl]-pyrrolidin-1-ylmethanone
CID 134701156
4-(1H-pyrazol-4-yl)-2-(2-pyrrolidin-1-ylethoxy)benzamide
CID 68758637
ethane;N-methyl-N-(2-morpholin-4-ylethyl)-3-propan-2-ylaniline;4-[2-(3-propan-2-ylphenoxy)ethyl]morpholine;1-[2-(3-propan-2-ylphenoxy)ethyl]piperidine
CID 167535418
N-methyl-N-(2-morpholin-4-ylethyl)-3-nitroaniline
CID 173013317
7-hydroxy-8-methoxy-2-[4-[methyl(2-piperidin-1-ylethyl)amino]phenyl]chromen-4-one
CID 164861295

Frequently Asked Questions

What is the IUPAC name of 3-[4-[methyl(2-morpholin-4-ylethyl)amino]-2-piperidin-1-ylphenyl]-5-(1H-pyrazol-4-yl)furan-2-carboxamide?
The IUPAC name of 3-[4-[methyl(2-morpholin-4-ylethyl)amino]-2-piperidin-1-ylphenyl]-5-(1H-pyrazol-4-yl)furan-2-carboxamide (CID 175918869) is 3-[4-[methyl(2-morpholin-4-ylethyl)amino]-2-piperidin-1-ylphenyl]-5-(1H-pyrazol-4-yl)furan-2-carboxamide.
What is the SMILES notation for 3-[4-[methyl(2-morpholin-4-ylethyl)amino]-2-piperidin-1-ylphenyl]-5-(1H-pyrazol-4-yl)furan-2-carboxamide?
The canonical SMILES for 3-[4-[methyl(2-morpholin-4-ylethyl)amino]-2-piperidin-1-ylphenyl]-5-(1H-pyrazol-4-yl)furan-2-carboxamide is CN(CCN1CCOCC1)c1ccc(-c2cc(-c3cn[nH]c3)oc2C(N)=O)c(N2CCCCC2)c1.
What is the InChIKey of 3-[4-[methyl(2-morpholin-4-ylethyl)amino]-2-piperidin-1-ylphenyl]-5-(1H-pyrazol-4-yl)furan-2-carboxamide?
The InChIKey is FGWKFFZIQOBCJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H34N6O3/c1-30(9-10-31-11-13-34-14-12-31)20-5-6-21(23(15-20)32-7-3-2-4-8-32)22-16-24(19-17-28-29-18-19)35-25(22)26(27)33/h5-6,15-18H,2-4,7-14H2,1H3,(H2,27,33)(H,28,29).
What are the key properties of 3-[4-[methyl(2-morpholin-4-ylethyl)amino]-2-piperidin-1-ylphenyl]-5-(1H-pyrazol-4-yl)furan-2-carboxamide?
3-[4-[methyl(2-morpholin-4-ylethyl)amino]-2-piperidin-1-ylphenyl]-5-(1H-pyrazol-4-yl)furan-2-carboxamide has a molecular weight of 478.60 g/mol, XLogP of 3.19, 8 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-[methyl(2-morpholin-4-ylethyl)amino]-2-piperidin-1-ylphenyl]-5-(1H-pyrazol-4-yl)furan-2-carboxamide is sourced from PubChem (CID 175918869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).