5-cyclopropyl-N,N-dimethyl-3-(pyridin-3-ylamino)-5H-chromeno[4,3-c]pyridine-8-carboxamide

C23H22N4O2 — CID 142611972

IUPAC5-cyclopropyl-N,N-dimethyl-3-(pyridin-3-ylamino)-5H-chromeno[4,3-c]pyridine-8-carboxamide
SMILESCN(C)C(=O)c1ccc2c(c1)OC(C1CC1)c1cc(Nc3cccnc3)ncc1-2
InChIInChI=1S/C23H22N4O2/c1-27(2)23(28)15-7-8-17-19-13-25-21(26-16-4-3-9-24-12-16)11-18(19)22(14-5-6-14)29-20(17)10-15/h3-4,7-14,22H,5-6H2,1-2H3,(H,25,26)
InChIKeyISSDVXMQXPEFGI-UHFFFAOYSA-N
MW386.46 g/mol
LogP4.43
Rot. Bonds4

About 5-cyclopropyl-N,N-dimethyl-3-(pyridin-3-ylamino)-5H-chromeno[4,3-c]pyridine-8-carboxamide

5-cyclopropyl-N,N-dimethyl-3-(pyridin-3-ylamino)-5H-chromeno[4,3-c]pyridine-8-carboxamide (PubChem CID 142611972) has the molecular formula C23H22N4O2 and a molecular weight of 386.46 g/mol. Its IUPAC name is 5-cyclopropyl-N,N-dimethyl-3-(pyridin-3-ylamino)-5H-chromeno[4,3-c]pyridine-8-carboxamide.

Molecular Properties

Compound Name5-cyclopropyl-N,N-dimethyl-3-(pyridin-3-ylamino)-5H-chromeno[4,3-c]pyridine-8-carboxamide
PubChem CID142611972
Molecular FormulaC23H22N4O2
Molecular Weight386.46 g/mol
Exact Mass386.17
IUPAC Name5-cyclopropyl-N,N-dimethyl-3-(pyridin-3-ylamino)-5H-chromeno[4,3-c]pyridine-8-carboxamide
SMILESCN(C)C(=O)c1ccc2c(c1)OC(C1CC1)c1cc(Nc3cccnc3)ncc1-2
InChIInChI=1S/C23H22N4O2/c1-27(2)23(28)15-7-8-17-19-13-25-21(26-16-4-3-9-24-12-16)11-18(19)22(14-5-6-14)29-20(17)10-15/h3-4,7-14,22H,5-6H2,1-2H3,(H,25,26)
InChIKeyISSDVXMQXPEFGI-UHFFFAOYSA-N
XLogP4.43
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.46
LogP ≤ 54.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-N,N-dimethyl-3-(pyridin-3-ylamino)-5H-chromeno[4,3-c]pyridine-8-carboxamide?
The IUPAC name of 5-cyclopropyl-N,N-dimethyl-3-(pyridin-3-ylamino)-5H-chromeno[4,3-c]pyridine-8-carboxamide (CID 142611972) is 5-cyclopropyl-N,N-dimethyl-3-(pyridin-3-ylamino)-5H-chromeno[4,3-c]pyridine-8-carboxamide.
What is the SMILES notation for 5-cyclopropyl-N,N-dimethyl-3-(pyridin-3-ylamino)-5H-chromeno[4,3-c]pyridine-8-carboxamide?
The canonical SMILES for 5-cyclopropyl-N,N-dimethyl-3-(pyridin-3-ylamino)-5H-chromeno[4,3-c]pyridine-8-carboxamide is CN(C)C(=O)c1ccc2c(c1)OC(C1CC1)c1cc(Nc3cccnc3)ncc1-2.
What is the InChIKey of 5-cyclopropyl-N,N-dimethyl-3-(pyridin-3-ylamino)-5H-chromeno[4,3-c]pyridine-8-carboxamide?
The InChIKey is ISSDVXMQXPEFGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N4O2/c1-27(2)23(28)15-7-8-17-19-13-25-21(26-16-4-3-9-24-12-16)11-18(19)22(14-5-6-14)29-20(17)10-15/h3-4,7-14,22H,5-6H2,1-2H3,(H,25,26).
What are the key properties of 5-cyclopropyl-N,N-dimethyl-3-(pyridin-3-ylamino)-5H-chromeno[4,3-c]pyridine-8-carboxamide?
5-cyclopropyl-N,N-dimethyl-3-(pyridin-3-ylamino)-5H-chromeno[4,3-c]pyridine-8-carboxamide has a molecular weight of 386.46 g/mol, XLogP of 4.43, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-N,N-dimethyl-3-(pyridin-3-ylamino)-5H-chromeno[4,3-c]pyridine-8-carboxamide is sourced from PubChem (CID 142611972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).