4-[4-(2-pyridin-2-ylethoxy)-6-(6,7,8,9-tetrahydro-5H-carbazol-3-ylmethyl)-2-pyridinyl]morpholine

C29H32N4O2 — CID 58060121

IUPAC4-[4-(2-pyridin-2-ylethoxy)-6-(6,7,8,9-tetrahydro-5H-carbazol-3-ylmethyl)-2-pyridinyl]morpholine
SMILESc1ccc(CCOc2cc(Cc3ccc4[nH]c5c(c4c3)CCCC5)nc(N3CCOCC3)c2)nc1
InChIInChI=1S/C29H32N4O2/c1-2-7-27-25(6-1)26-18-21(8-9-28(26)32-27)17-23-19-24(35-14-10-22-5-3-4-11-30-22)20-29(31-23)33-12-15-34-16-13-33/h3-5,8-9,11,18-20,32H,1-2,6-7,10,12-17H2
InChIKeyWIQOLDAOVPOASR-UHFFFAOYSA-N
MW468.60 g/mol
LogP4.89
Rot. Bonds7

About 4-[4-(2-pyridin-2-ylethoxy)-6-(6,7,8,9-tetrahydro-5H-carbazol-3-ylmethyl)-2-pyridinyl]morpholine

4-[4-(2-pyridin-2-ylethoxy)-6-(6,7,8,9-tetrahydro-5H-carbazol-3-ylmethyl)-2-pyridinyl]morpholine (PubChem CID 58060121) has the molecular formula C29H32N4O2 and a molecular weight of 468.60 g/mol. Its IUPAC name is 4-[4-(2-pyridin-2-ylethoxy)-6-(6,7,8,9-tetrahydro-5H-carbazol-3-ylmethyl)-2-pyridinyl]morpholine.

Molecular Properties

Compound Name4-[4-(2-pyridin-2-ylethoxy)-6-(6,7,8,9-tetrahydro-5H-carbazol-3-ylmethyl)-2-pyridinyl]morpholine
PubChem CID58060121
Molecular FormulaC29H32N4O2
Molecular Weight468.60 g/mol
Exact Mass468.25
IUPAC Name4-[4-(2-pyridin-2-ylethoxy)-6-(6,7,8,9-tetrahydro-5H-carbazol-3-ylmethyl)-2-pyridinyl]morpholine
SMILESc1ccc(CCOc2cc(Cc3ccc4[nH]c5c(c4c3)CCCC5)nc(N3CCOCC3)c2)nc1
InChIInChI=1S/C29H32N4O2/c1-2-7-27-25(6-1)26-18-21(8-9-28(26)32-27)17-23-19-24(35-14-10-22-5-3-4-11-30-22)20-29(31-23)33-12-15-34-16-13-33/h3-5,8-9,11,18-20,32H,1-2,6-7,10,12-17H2
InChIKeyWIQOLDAOVPOASR-UHFFFAOYSA-N
XLogP4.89
TPSA63.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500468.60
LogP ≤ 54.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

Analyze 4-[4-(2-pyridin-2-ylethoxy)-6-(6,7,8,9-tetrahydro-5H-carbazol-3-ylmethyl)-2-pyridinyl]morpholine with MolForge

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Related Compounds

N-[(2,3-dimethyl-1H-indol-5-yl)methyl]-1-[4-morpholin-4-yl-6-(2-pyridin-2-ylethoxy)pyrimidin-2-yl]methanimine
CID 58060102
methanol;N-methyl-4-morpholin-4-yl-6-(2-pyridin-2-ylethoxy)pyrimidin-2-amine
CID 143450374
4-[2-[[2-[(2,3-dimethyl-1H-indol-5-yl)methyl]-6-morpholin-4-yl-4-pyridinyl]oxy]ethyl]-1-methylpiperidin-2-one
CID 58060129
2,3-dimethyl-N-[(E)-[6-morpholin-4-yl-2-(2-pyridin-2-ylethoxy)pyrimidin-4-yl]methylideneamino]-1H-indol-5-amine
CID 11454233
4-[6-(9H-carbazol-3-yloxy)-4-(2-morpholin-4-ylethoxy)-2-pyridinyl]morpholine;ethane;propane
CID 143340736
N-[3-(pyridin-2-ylmethoxy)phenyl]-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide
CID 33498777
4-[2-methylidene-6-(2-pyridin-2-ylethoxy)-5H-pyrimidin-4-yl]morpholine
CID 123539004
2-(pyridin-2-ylmethyl)-7-(6,7,8,9-tetrahydro-5H-carbazole-3-carbonyl)-2,7-diazaspiro[4.4]nonan-1-one
CID 175643597
5-[(3-methylphenyl)methylideneamino]-6-morpholin-4-yl-2-(2-pyridin-2-ylethoxy)pyrimidin-4-amine
CID 140649039
N-[(E)-[4-morpholin-4-yl-6-(2-pyridin-2-ylethoxy)-1,3,5-triazin-2-yl]methylideneamino]naphthalen-2-amine
CID 11178549
4-[6-[4-(2-pyridin-2-ylethyl)piperazin-1-yl]pyrimidin-4-yl]morpholine
CID 171326602
N-[(3-fluorophenyl)methylideneamino]-6-morpholin-4-yl-2-(2-pyridin-2-ylethoxy)pyrimidin-4-amine
CID 66681810

Frequently Asked Questions

What is the IUPAC name of 4-[4-(2-pyridin-2-ylethoxy)-6-(6,7,8,9-tetrahydro-5H-carbazol-3-ylmethyl)-2-pyridinyl]morpholine?
The IUPAC name of 4-[4-(2-pyridin-2-ylethoxy)-6-(6,7,8,9-tetrahydro-5H-carbazol-3-ylmethyl)-2-pyridinyl]morpholine (CID 58060121) is 4-[4-(2-pyridin-2-ylethoxy)-6-(6,7,8,9-tetrahydro-5H-carbazol-3-ylmethyl)-2-pyridinyl]morpholine.
What is the SMILES notation for 4-[4-(2-pyridin-2-ylethoxy)-6-(6,7,8,9-tetrahydro-5H-carbazol-3-ylmethyl)-2-pyridinyl]morpholine?
The canonical SMILES for 4-[4-(2-pyridin-2-ylethoxy)-6-(6,7,8,9-tetrahydro-5H-carbazol-3-ylmethyl)-2-pyridinyl]morpholine is c1ccc(CCOc2cc(Cc3ccc4[nH]c5c(c4c3)CCCC5)nc(N3CCOCC3)c2)nc1.
What is the InChIKey of 4-[4-(2-pyridin-2-ylethoxy)-6-(6,7,8,9-tetrahydro-5H-carbazol-3-ylmethyl)-2-pyridinyl]morpholine?
The InChIKey is WIQOLDAOVPOASR-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H32N4O2/c1-2-7-27-25(6-1)26-18-21(8-9-28(26)32-27)17-23-19-24(35-14-10-22-5-3-4-11-30-22)20-29(31-23)33-12-15-34-16-13-33/h3-5,8-9,11,18-20,32H,1-2,6-7,10,12-17H2.
What are the key properties of 4-[4-(2-pyridin-2-ylethoxy)-6-(6,7,8,9-tetrahydro-5H-carbazol-3-ylmethyl)-2-pyridinyl]morpholine?
4-[4-(2-pyridin-2-ylethoxy)-6-(6,7,8,9-tetrahydro-5H-carbazol-3-ylmethyl)-2-pyridinyl]morpholine has a molecular weight of 468.60 g/mol, XLogP of 4.89, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(2-pyridin-2-ylethoxy)-6-(6,7,8,9-tetrahydro-5H-carbazol-3-ylmethyl)-2-pyridinyl]morpholine is sourced from PubChem (CID 58060121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).