2-[3-(1-methyl-5H-imidazo[1,2-a]pyridin-2-yl)phenoxy]-9-(4-propan-2-yl-2-pyridinyl)carbazole

C34H30N4O — CID 162281126

IUPAC2-[3-(1-methyl-5H-imidazo[1,2-a]pyridin-2-yl)phenoxy]-9-(4-propan-2-yl-2-pyridinyl)carbazole
SMILESCC(C)c1ccnc(-n2c3ccccc3c3ccc(Oc4cccc(C5=CN6CC=CC=C6N5C)c4)cc32)c1
InChIInChI=1S/C34H30N4O/c1-23(2)24-16-17-35-33(20-24)38-30-12-5-4-11-28(30)29-15-14-27(21-31(29)38)39-26-10-8-9-25(19-26)32-22-37-18-7-6-13-34(37)36(32)3/h4-17,19-23H,18H2,1-3H3
InChIKeyUMGAJVGGRXMUDB-UHFFFAOYSA-N
MW510.64 g/mol
LogP8.05
Rot. Bonds5

About 2-[3-(1-methyl-5H-imidazo[1,2-a]pyridin-2-yl)phenoxy]-9-(4-propan-2-yl-2-pyridinyl)carbazole

2-[3-(1-methyl-5H-imidazo[1,2-a]pyridin-2-yl)phenoxy]-9-(4-propan-2-yl-2-pyridinyl)carbazole (PubChem CID 162281126) has the molecular formula C34H30N4O and a molecular weight of 510.64 g/mol. Its IUPAC name is 2-[3-(1-methyl-5H-imidazo[1,2-a]pyridin-2-yl)phenoxy]-9-(4-propan-2-yl-2-pyridinyl)carbazole.

Molecular Properties

Compound Name2-[3-(1-methyl-5H-imidazo[1,2-a]pyridin-2-yl)phenoxy]-9-(4-propan-2-yl-2-pyridinyl)carbazole
PubChem CID162281126
Molecular FormulaC34H30N4O
Molecular Weight510.64 g/mol
Exact Mass510.24
IUPAC Name2-[3-(1-methyl-5H-imidazo[1,2-a]pyridin-2-yl)phenoxy]-9-(4-propan-2-yl-2-pyridinyl)carbazole
SMILESCC(C)c1ccnc(-n2c3ccccc3c3ccc(Oc4cccc(C5=CN6CC=CC=C6N5C)c4)cc32)c1
InChIInChI=1S/C34H30N4O/c1-23(2)24-16-17-35-33(20-24)38-30-12-5-4-11-28(30)29-15-14-27(21-31(29)38)39-26-10-8-9-25(19-26)32-22-37-18-7-6-13-34(37)36(32)3/h4-17,19-23H,18H2,1-3H3
InChIKeyUMGAJVGGRXMUDB-UHFFFAOYSA-N
XLogP8.05
TPSA33.53 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500510.64
LogP ≤ 58.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

9-(4-propan-2-yl-2-pyridinyl)-2-[3-[1-(2,4,6-trimethylphenyl)-8aH-imidazo[1,2-a]pyridin-3-yl]phenoxy]carbazole
CID 162281140
9-(4-propan-2-yl-2-pyridinyl)-2-(3-pyridin-2-yloxyphenyl)carbazole
CID 153421041
2-[3-[4-(2,6-diphenylphenyl)pyrazol-1-yl]phenoxy]-9-(4-propan-2-yl-2-pyridinyl)carbazole
CID 153413086
2-[3-(3-methyl-2H-imidazol-1-yl)phenoxy]-5-phenyl-10-(4-propan-2-yl-2-pyridinyl)indolo[3,2-b]indole
CID 169031337
2-[3-[3-(2,6-diphenylphenyl)-2H-imidazol-3-ium-2-id-1-yl]phenoxy]-9-(4-propan-2-yl-2-pyridinyl)carbazole
CID 171610282
2-[9-(4-propan-2-yl-2-pyridinyl)carbazol-2-yl]oxyquinoline-8-thiol
CID 176606775
2-[3-[4-(4-methyl-2,6-diphenylphenyl)pyrazol-1-yl]phenoxy]-9-(4-propan-2-yl-2-pyridinyl)carbazole
CID 153414664
2-[3-[4-(3,5-ditert-butylphenyl)-3,5-di(propan-2-yl)pyrazol-1-yl]phenoxy]-9-(4-propan-2-yl-2-pyridinyl)carbazole
CID 153415433
2-[3-[3-(4-fluorophenyl)-2H-benzimidazol-1-yl]-5-phenylphenoxy]-9-(4-propan-2-yl-2-pyridinyl)carbazole
CID 172533980
2-[3-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]phenyl]-1-methyl-5H-imidazo[1,2-a]pyridine
CID 162285797
2-[3-(benzimidazol-1-yl)phenoxy]-9-[4-[2,4,6-tri(propan-2-yl)phenyl]-2-pyridinyl]carbazole
CID 163609872
1-N,1-N,3-N,3-N,5-pentamethyl-2-[1-[3-[9-(4-propan-2-yl-2-pyridinyl)carbazol-2-yl]oxyphenyl]pyrazol-4-yl]benzene-1,3-diamine
CID 153414866

Frequently Asked Questions

What is the IUPAC name of 2-[3-(1-methyl-5H-imidazo[1,2-a]pyridin-2-yl)phenoxy]-9-(4-propan-2-yl-2-pyridinyl)carbazole?
The IUPAC name of 2-[3-(1-methyl-5H-imidazo[1,2-a]pyridin-2-yl)phenoxy]-9-(4-propan-2-yl-2-pyridinyl)carbazole (CID 162281126) is 2-[3-(1-methyl-5H-imidazo[1,2-a]pyridin-2-yl)phenoxy]-9-(4-propan-2-yl-2-pyridinyl)carbazole.
What is the SMILES notation for 2-[3-(1-methyl-5H-imidazo[1,2-a]pyridin-2-yl)phenoxy]-9-(4-propan-2-yl-2-pyridinyl)carbazole?
The canonical SMILES for 2-[3-(1-methyl-5H-imidazo[1,2-a]pyridin-2-yl)phenoxy]-9-(4-propan-2-yl-2-pyridinyl)carbazole is CC(C)c1ccnc(-n2c3ccccc3c3ccc(Oc4cccc(C5=CN6CC=CC=C6N5C)c4)cc32)c1.
What is the InChIKey of 2-[3-(1-methyl-5H-imidazo[1,2-a]pyridin-2-yl)phenoxy]-9-(4-propan-2-yl-2-pyridinyl)carbazole?
The InChIKey is UMGAJVGGRXMUDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H30N4O/c1-23(2)24-16-17-35-33(20-24)38-30-12-5-4-11-28(30)29-15-14-27(21-31(29)38)39-26-10-8-9-25(19-26)32-22-37-18-7-6-13-34(37)36(32)3/h4-17,19-23H,18H2,1-3H3.
What are the key properties of 2-[3-(1-methyl-5H-imidazo[1,2-a]pyridin-2-yl)phenoxy]-9-(4-propan-2-yl-2-pyridinyl)carbazole?
2-[3-(1-methyl-5H-imidazo[1,2-a]pyridin-2-yl)phenoxy]-9-(4-propan-2-yl-2-pyridinyl)carbazole has a molecular weight of 510.64 g/mol, XLogP of 8.05, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(1-methyl-5H-imidazo[1,2-a]pyridin-2-yl)phenoxy]-9-(4-propan-2-yl-2-pyridinyl)carbazole is sourced from PubChem (CID 162281126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).