(1R)-7-methyl-2-(3-morpholin-4-ylpropyl)-1-pyridin-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione

C24H25N3O4 — CID 7161917

IUPAC(1R)-7-methyl-2-(3-morpholin-4-ylpropyl)-1-pyridin-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione
SMILESCc1ccc2oc3c(c(=O)c2c1)[C@H](c1ccccn1)N(CCCN1CCOCC1)C3=O
InChIInChI=1S/C24H25N3O4/c1-16-6-7-19-17(15-16)22(28)20-21(18-5-2-3-8-25-18)27(24(29)23(20)31-19)10-4-9-26-11-13-30-14-12-26/h2-3,5-8,15,21H,4,9-14H2,1H3/t21-/m0/s1
InChIKeyLNOGDENLEVDULI-NRFANRHFSA-N
MW419.48 g/mol
LogP2.76
Rot. Bonds5

About (1R)-7-methyl-2-(3-morpholin-4-ylpropyl)-1-pyridin-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione

(1R)-7-methyl-2-(3-morpholin-4-ylpropyl)-1-pyridin-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione (PubChem CID 7161917) has the molecular formula C24H25N3O4 and a molecular weight of 419.48 g/mol. Its IUPAC name is (1R)-7-methyl-2-(3-morpholin-4-ylpropyl)-1-pyridin-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione.

Molecular Properties

Compound Name(1R)-7-methyl-2-(3-morpholin-4-ylpropyl)-1-pyridin-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione
PubChem CID7161917
Molecular FormulaC24H25N3O4
Molecular Weight419.48 g/mol
Exact Mass419.18
IUPAC Name(1R)-7-methyl-2-(3-morpholin-4-ylpropyl)-1-pyridin-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione
SMILESCc1ccc2oc3c(c(=O)c2c1)[C@H](c1ccccn1)N(CCCN1CCOCC1)C3=O
InChIInChI=1S/C24H25N3O4/c1-16-6-7-19-17(15-16)22(28)20-21(18-5-2-3-8-25-18)27(24(29)23(20)31-19)10-4-9-26-11-13-30-14-12-26/h2-3,5-8,15,21H,4,9-14H2,1H3/t21-/m0/s1
InChIKeyLNOGDENLEVDULI-NRFANRHFSA-N
XLogP2.76
TPSA75.88 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms31
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500419.48
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of (1R)-7-methyl-2-(3-morpholin-4-ylpropyl)-1-pyridin-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione?
The IUPAC name of (1R)-7-methyl-2-(3-morpholin-4-ylpropyl)-1-pyridin-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione (CID 7161917) is (1R)-7-methyl-2-(3-morpholin-4-ylpropyl)-1-pyridin-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione.
What is the SMILES notation for (1R)-7-methyl-2-(3-morpholin-4-ylpropyl)-1-pyridin-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione?
The canonical SMILES for (1R)-7-methyl-2-(3-morpholin-4-ylpropyl)-1-pyridin-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione is Cc1ccc2oc3c(c(=O)c2c1)[C@H](c1ccccn1)N(CCCN1CCOCC1)C3=O.
What is the InChIKey of (1R)-7-methyl-2-(3-morpholin-4-ylpropyl)-1-pyridin-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione?
The InChIKey is LNOGDENLEVDULI-NRFANRHFSA-N. The full InChI is InChI=1S/C24H25N3O4/c1-16-6-7-19-17(15-16)22(28)20-21(18-5-2-3-8-25-18)27(24(29)23(20)31-19)10-4-9-26-11-13-30-14-12-26/h2-3,5-8,15,21H,4,9-14H2,1H3/t21-/m0/s1.
What are the key properties of (1R)-7-methyl-2-(3-morpholin-4-ylpropyl)-1-pyridin-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione?
(1R)-7-methyl-2-(3-morpholin-4-ylpropyl)-1-pyridin-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione has a molecular weight of 419.48 g/mol, XLogP of 2.76, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-7-methyl-2-(3-morpholin-4-ylpropyl)-1-pyridin-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione is sourced from PubChem (CID 7161917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).