2',8'-dipyridin-3-ylspiro[1,2-dihydropyrrole-3,10'-chromeno[3,2-b]pyridine]-5-amine

C25H19N5O — CID 141263152

IUPAC2',8'-dipyridin-3-ylspiro[1,2-dihydropyrrole-3,10'-chromeno[3,2-b]pyridine]-5-amine
SMILESNC1=CC2(CN1)c1cc(-c3cccnc3)ccc1Oc1ccc(-c3cccnc3)nc12
InChIInChI=1S/C25H19N5O/c26-23-12-25(15-29-23)19-11-16(17-3-1-9-27-13-17)5-7-21(19)31-22-8-6-20(30-24(22)25)18-4-2-10-28-14-18/h1-14,29H,15,26H2
InChIKeyMDTPBPINROWZFL-UHFFFAOYSA-N
MW405.46 g/mol
LogP4.00
Rot. Bonds2

About 2',8'-dipyridin-3-ylspiro[1,2-dihydropyrrole-3,10'-chromeno[3,2-b]pyridine]-5-amine

2',8'-dipyridin-3-ylspiro[1,2-dihydropyrrole-3,10'-chromeno[3,2-b]pyridine]-5-amine (PubChem CID 141263152) has the molecular formula C25H19N5O and a molecular weight of 405.46 g/mol. Its IUPAC name is 2',8'-dipyridin-3-ylspiro[1,2-dihydropyrrole-3,10'-chromeno[3,2-b]pyridine]-5-amine.

Molecular Properties

Compound Name2',8'-dipyridin-3-ylspiro[1,2-dihydropyrrole-3,10'-chromeno[3,2-b]pyridine]-5-amine
PubChem CID141263152
Molecular FormulaC25H19N5O
Molecular Weight405.46 g/mol
Exact Mass405.16
IUPAC Name2',8'-dipyridin-3-ylspiro[1,2-dihydropyrrole-3,10'-chromeno[3,2-b]pyridine]-5-amine
SMILESNC1=CC2(CN1)c1cc(-c3cccnc3)ccc1Oc1ccc(-c3cccnc3)nc12
InChIInChI=1S/C25H19N5O/c26-23-12-25(15-29-23)19-11-16(17-3-1-9-27-13-17)5-7-21(19)31-22-8-6-20(30-24(22)25)18-4-2-10-28-14-18/h1-14,29H,15,26H2
InChIKeyMDTPBPINROWZFL-UHFFFAOYSA-N
XLogP4.00
TPSA85.95 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.46
LogP ≤ 54.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-[(3S)-5-amino-7'-pyridin-3-ylspiro[1,2-dihydropyrrole-3,9'-xanthene]-2'-yl]oxybenzonitrile
CID 141263253
1-[(3S)-5-amino-7'-pyridin-3-ylspiro[1,2-dihydropyrrole-3,9'-xanthene]-2'-yl]oxy-2-methylbutan-2-ol
CID 141263135
1-[(3S)-5-amino-7'-pyrimidin-5-ylspiro[1,2-dihydropyrrole-3,9'-xanthene]-2'-yl]oxypropan-2-one
CID 141263218
(3S)-3'-[(E)-3,3-dimethylbut-1-enyl]-7'-pyrimidin-5-ylspiro[1,2-dihydropyrrole-3,5'-chromeno[2,3-c]pyridine]-5-amine
CID 141263200
(3R)-2'-(3-methoxy-3-methylbutyl)-7'-pyrimidin-5-ylspiro[1,2-dihydropyrrole-3,9'-xanthene]-5-amine
CID 141263262
(4R)-2'-pyridin-3-yl-7'-pyrimidin-5-ylspiro[5H-1,3-oxazole-4,9'-xanthene]-2-amine
CID 59272337
(4S)-7'-pyridin-3-ylspiro[5H-1,3-oxazole-4,5'-chromeno[2,3-c]pyridine]-2-amine
CID 58466160
(4S)-2'-(3,3-dimethylbut-1-enyl)-8'-pyridin-3-ylspiro[5H-1,3-oxazole-4,10'-chromeno[3,2-b]pyridine]-2-amine
CID 123427792
1'-fluoro-3',7'-dipyridin-3-ylspiro[5H-1,3-oxazole-4,5'-chromeno[2,3-c]pyridine]-2-amine
CID 67241930
(3S)-7'-bromo-3'-chlorospiro[1,2-dihydropyrrole-3,5'-chromeno[2,3-c]pyridine]-5-amine
CID 141263181
2,4-diphenyl-6-[3-(7-pyridin-3-ylspiro[fluorene-9,9'-xanthene]-2-yl)phenyl]-1,3,5-triazine
CID 164793285
2-(3-pyridin-3-yl-9,9'-spirobi[xanthene]-3'-yl)pyridine
CID 118698448

Frequently Asked Questions

What is the IUPAC name of 2',8'-dipyridin-3-ylspiro[1,2-dihydropyrrole-3,10'-chromeno[3,2-b]pyridine]-5-amine?
The IUPAC name of 2',8'-dipyridin-3-ylspiro[1,2-dihydropyrrole-3,10'-chromeno[3,2-b]pyridine]-5-amine (CID 141263152) is 2',8'-dipyridin-3-ylspiro[1,2-dihydropyrrole-3,10'-chromeno[3,2-b]pyridine]-5-amine.
What is the SMILES notation for 2',8'-dipyridin-3-ylspiro[1,2-dihydropyrrole-3,10'-chromeno[3,2-b]pyridine]-5-amine?
The canonical SMILES for 2',8'-dipyridin-3-ylspiro[1,2-dihydropyrrole-3,10'-chromeno[3,2-b]pyridine]-5-amine is NC1=CC2(CN1)c1cc(-c3cccnc3)ccc1Oc1ccc(-c3cccnc3)nc12.
What is the InChIKey of 2',8'-dipyridin-3-ylspiro[1,2-dihydropyrrole-3,10'-chromeno[3,2-b]pyridine]-5-amine?
The InChIKey is MDTPBPINROWZFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H19N5O/c26-23-12-25(15-29-23)19-11-16(17-3-1-9-27-13-17)5-7-21(19)31-22-8-6-20(30-24(22)25)18-4-2-10-28-14-18/h1-14,29H,15,26H2.
What are the key properties of 2',8'-dipyridin-3-ylspiro[1,2-dihydropyrrole-3,10'-chromeno[3,2-b]pyridine]-5-amine?
2',8'-dipyridin-3-ylspiro[1,2-dihydropyrrole-3,10'-chromeno[3,2-b]pyridine]-5-amine has a molecular weight of 405.46 g/mol, XLogP of 4.00, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2',8'-dipyridin-3-ylspiro[1,2-dihydropyrrole-3,10'-chromeno[3,2-b]pyridine]-5-amine is sourced from PubChem (CID 141263152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).