2-methoxy-5-morpholin-4-yl-N-[5-[4-(pyrrolidin-1-ylmethyl)phenyl]-3-pyridinyl]pyridine-3-sulfonamide

C26H31N5O4S — CID 164621493

IUPAC2-methoxy-5-morpholin-4-yl-N-[5-[4-(pyrrolidin-1-ylmethyl)phenyl]-3-pyridinyl]pyridine-3-sulfonamide
SMILESCOc1ncc(N2CCOCC2)cc1S(=O)(=O)Nc1cncc(-c2ccc(CN3CCCC3)cc2)c1
InChIInChI=1S/C26H31N5O4S/c1-34-26-25(15-24(18-28-26)31-10-12-35-13-11-31)36(32,33)29-23-14-22(16-27-17-23)21-6-4-20(5-7-21)19-30-8-2-3-9-30/h4-7,14-18,29H,2-3,8-13,19H2,1H3
InChIKeyJPGMGZWJJMJWEV-UHFFFAOYSA-N
MW509.63 g/mol
LogP3.39
Rot. Bonds8

About 2-methoxy-5-morpholin-4-yl-N-[5-[4-(pyrrolidin-1-ylmethyl)phenyl]-3-pyridinyl]pyridine-3-sulfonamide

2-methoxy-5-morpholin-4-yl-N-[5-[4-(pyrrolidin-1-ylmethyl)phenyl]-3-pyridinyl]pyridine-3-sulfonamide (PubChem CID 164621493) has the molecular formula C26H31N5O4S and a molecular weight of 509.63 g/mol. Its IUPAC name is 2-methoxy-5-morpholin-4-yl-N-[5-[4-(pyrrolidin-1-ylmethyl)phenyl]-3-pyridinyl]pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-methoxy-5-morpholin-4-yl-N-[5-[4-(pyrrolidin-1-ylmethyl)phenyl]-3-pyridinyl]pyridine-3-sulfonamide
PubChem CID164621493
Molecular FormulaC26H31N5O4S
Molecular Weight509.63 g/mol
Exact Mass509.21
IUPAC Name2-methoxy-5-morpholin-4-yl-N-[5-[4-(pyrrolidin-1-ylmethyl)phenyl]-3-pyridinyl]pyridine-3-sulfonamide
SMILESCOc1ncc(N2CCOCC2)cc1S(=O)(=O)Nc1cncc(-c2ccc(CN3CCCC3)cc2)c1
InChIInChI=1S/C26H31N5O4S/c1-34-26-25(15-24(18-28-26)31-10-12-35-13-11-31)36(32,33)29-23-14-22(16-27-17-23)21-6-4-20(5-7-21)19-30-8-2-3-9-30/h4-7,14-18,29H,2-3,8-13,19H2,1H3
InChIKeyJPGMGZWJJMJWEV-UHFFFAOYSA-N
XLogP3.39
TPSA96.89 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds8
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500509.63
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze 2-methoxy-5-morpholin-4-yl-N-[5-[4-(pyrrolidin-1-ylmethyl)phenyl]-3-pyridinyl]pyridine-3-sulfonamide 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

2-methoxy-N-[5-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-3-pyridinyl]-5-morpholin-4-ylpyridine-3-sulfonamide
CID 137442581
N-[5-[2-fluoro-4-[[(3S,5R)-3,4,5-trimethylpiperazin-1-yl]methyl]phenyl]-3-pyridinyl]-2-methoxy-5-morpholin-4-ylpyridine-3-sulfonamide
CID 137442765
N-[2-[2-fluoro-4-(piperidin-1-ylmethyl)phenyl]-4-pyridinyl]-2-methoxy-5-morpholin-4-ylpyridine-3-sulfonamide
CID 130332656
N-[2-[3-fluoro-4-(pyrrolidin-1-ylmethyl)phenyl]-4-pyridinyl]-2-methoxy-5-morpholin-4-ylpyridine-3-sulfonamide
CID 130302663
2-methoxy-5-morpholin-4-yl-N-[2-[4-[[4-(oxetan-3-yl)piperazin-1-yl]methyl]phenyl]-4-pyridinyl]pyridine-3-sulfonamide
CID 130302803
N-[2-[2-fluoro-4-(piperazin-1-ylmethyl)phenyl]-4-pyridinyl]-2-methoxy-5-morpholin-4-ylpyridine-3-sulfonamide
CID 130332501
N-[2-[2,6-difluoro-4-[(4-propan-2-ylpiperazin-1-yl)methyl]phenyl]-4-pyridinyl]-2-methoxy-5-morpholin-4-ylpyridine-3-sulfonamide
CID 130302685
N-[2-[2-fluoro-4-[(2-methylpyrrolidin-1-yl)methyl]phenyl]-4-pyridinyl]-2-methoxy-5-morpholin-4-ylpyridine-3-sulfonamide
CID 130302703
5-chloro-N-[2-[2-fluoro-4-(pyrrolidin-1-ylmethyl)phenyl]-4-pyridinyl]-2-methoxypyridine-3-sulfonamide
CID 130332651
5-[4-[(dimethylamino)methyl]phenyl]-N-[(2-ethoxy-5-morpholin-4-yl-3-pyridinyl)sulfanyl]pyridin-3-amine
CID 142521409
2-[2-fluoro-4-(pyrrolidin-1-ylmethyl)phenyl]-N-[(2-methoxy-5-morpholin-4-yl-3-pyridinyl)sulfanyl]pyridin-4-amine
CID 130332573
4-[[4-[4-(piperidin-1-ylmethyl)phenyl]phenyl]methyl]morpholine
CID 44588214

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-5-morpholin-4-yl-N-[5-[4-(pyrrolidin-1-ylmethyl)phenyl]-3-pyridinyl]pyridine-3-sulfonamide?
The IUPAC name of 2-methoxy-5-morpholin-4-yl-N-[5-[4-(pyrrolidin-1-ylmethyl)phenyl]-3-pyridinyl]pyridine-3-sulfonamide (CID 164621493) is 2-methoxy-5-morpholin-4-yl-N-[5-[4-(pyrrolidin-1-ylmethyl)phenyl]-3-pyridinyl]pyridine-3-sulfonamide.
What is the SMILES notation for 2-methoxy-5-morpholin-4-yl-N-[5-[4-(pyrrolidin-1-ylmethyl)phenyl]-3-pyridinyl]pyridine-3-sulfonamide?
The canonical SMILES for 2-methoxy-5-morpholin-4-yl-N-[5-[4-(pyrrolidin-1-ylmethyl)phenyl]-3-pyridinyl]pyridine-3-sulfonamide is COc1ncc(N2CCOCC2)cc1S(=O)(=O)Nc1cncc(-c2ccc(CN3CCCC3)cc2)c1.
What is the InChIKey of 2-methoxy-5-morpholin-4-yl-N-[5-[4-(pyrrolidin-1-ylmethyl)phenyl]-3-pyridinyl]pyridine-3-sulfonamide?
The InChIKey is JPGMGZWJJMJWEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H31N5O4S/c1-34-26-25(15-24(18-28-26)31-10-12-35-13-11-31)36(32,33)29-23-14-22(16-27-17-23)21-6-4-20(5-7-21)19-30-8-2-3-9-30/h4-7,14-18,29H,2-3,8-13,19H2,1H3.
What are the key properties of 2-methoxy-5-morpholin-4-yl-N-[5-[4-(pyrrolidin-1-ylmethyl)phenyl]-3-pyridinyl]pyridine-3-sulfonamide?
2-methoxy-5-morpholin-4-yl-N-[5-[4-(pyrrolidin-1-ylmethyl)phenyl]-3-pyridinyl]pyridine-3-sulfonamide has a molecular weight of 509.63 g/mol, XLogP of 3.39, 8 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-5-morpholin-4-yl-N-[5-[4-(pyrrolidin-1-ylmethyl)phenyl]-3-pyridinyl]pyridine-3-sulfonamide is sourced from PubChem (CID 164621493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).