4-{2-[2-Methyl-6-((2S,3'R)-2-methyl-[1,3']bipyrrolidinyl-1'-yl)-pyridin-3-ylamino]-ethyl}-tetrahydro-pyran-4-carboxylic acid methyl ester

HCID 71280337
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Basic information

Standard SMILES
COC(=O)C1(CCNc2ccc(N3CC[C@@H](N4CCC[C@@H]4C)C3)nc2C)CCOCC1
InChIKey
UONTVEANDRSOBW-AZUAARDMSA-N
Molecular formula
C24H38N4O3
Average molar mass
430.6 g/mol

Names & identifiers

Preferred name
4-{2-[2-Methyl-6-((2S,3'R)-2-methyl-[1,3']bipyrrolidinyl-1'-yl)-pyridin-3-ylamino]-ethyl}-tetrahydro-pyran-4-carboxylic acid methyl ester
IUPAC
methyl 4-[2-[[2-methyl-6-[(3R)-3-[(2S)-2-methylpyrrolidin-1-yl]pyrrolidin-1-yl]-3-pyridinyl]amino]ethyl]oxane-4-carboxylate

Names & synonyms

SCHEMBL14738294UONTVEANDRSOBW-AZUAARDMSA-N4-{2-[2-Methyl-6-((2S,3'R)-2-methyl-[1,3']bipyrrolidinyl-1'-yl)-pyridin-3-ylamino]-ethyl}-tetrahydro-pyran-4-carboxylic acid methyl ester

Database identifiers

PubChem CID
71280337

Properties

Computed structural properties

XLogP
3.2
Topological polar surface area
66.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
8
Heavy atoms
31

Related reactions

2 records
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Compound notes

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