1-(3-amino-5-methyl-5H-chromeno[4,3-c]pyridin-8-yl)pyrrolidin-2-one

C17H17N3O2 — CID 142611989

IUPAC1-(3-amino-5-methyl-5H-chromeno[4,3-c]pyridin-8-yl)pyrrolidin-2-one
SMILESCC1Oc2cc(N3CCCC3=O)ccc2-c2cnc(N)cc21
InChIInChI=1S/C17H17N3O2/c1-10-13-8-16(18)19-9-14(13)12-5-4-11(7-15(12)22-10)20-6-2-3-17(20)21/h4-5,7-10H,2-3,6H2,1H3,(H2,18,19)
InChIKeySQOQDQCSZASEHW-UHFFFAOYSA-N
MW295.34 g/mol
LogP2.91
Rot. Bonds1

About 1-(3-amino-5-methyl-5H-chromeno[4,3-c]pyridin-8-yl)pyrrolidin-2-one

1-(3-amino-5-methyl-5H-chromeno[4,3-c]pyridin-8-yl)pyrrolidin-2-one (PubChem CID 142611989) has the molecular formula C17H17N3O2 and a molecular weight of 295.34 g/mol. Its IUPAC name is 1-(3-amino-5-methyl-5H-chromeno[4,3-c]pyridin-8-yl)pyrrolidin-2-one.

Molecular Properties

Compound Name1-(3-amino-5-methyl-5H-chromeno[4,3-c]pyridin-8-yl)pyrrolidin-2-one
PubChem CID142611989
Molecular FormulaC17H17N3O2
Molecular Weight295.34 g/mol
Exact Mass295.13
IUPAC Name1-(3-amino-5-methyl-5H-chromeno[4,3-c]pyridin-8-yl)pyrrolidin-2-one
SMILESCC1Oc2cc(N3CCCC3=O)ccc2-c2cnc(N)cc21
InChIInChI=1S/C17H17N3O2/c1-10-13-8-16(18)19-9-14(13)12-5-4-11(7-15(12)22-10)20-6-2-3-17(20)21/h4-5,7-10H,2-3,6H2,1H3,(H2,18,19)
InChIKeySQOQDQCSZASEHW-UHFFFAOYSA-N
XLogP2.91
TPSA68.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.34
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[(5S)-3-[(5-amino-3-pyridinyl)amino]-5-methyl-5H-chromeno[4,3-c]pyridin-8-yl]pyrrolidin-2-one
CID 155225587
1-[5-methyl-3-(pyridazin-3-ylamino)-5H-chromeno[4,3-c]pyridin-8-yl]pyrrolidin-2-one
CID 142612064
1-[3-[[2-(hydroxymethyl)-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazin-7-yl]amino]-5-methyl-5H-chromeno[4,3-c]pyridin-8-yl]pyrrolidin-2-one
CID 166707860
1-(5-methyl-4-pyridin-4-yl-5H-chromeno[4,3-c]pyridin-8-yl)pyrrolidin-2-one
CID 142612210
1-[5-methyl-3-[[1-(2-methylpropanoyl)-2,3-dihydropyrido[2,3-b][1,4]oxazin-7-yl]amino]-5H-chromeno[4,3-c]pyridin-8-yl]pyrrolidin-2-one
CID 142612084
1-[(3-aminophenyl)methyl]-3-[5-[[5-methyl-8-(2-oxopyrrolidin-1-yl)-5H-chromeno[4,3-c]pyridin-3-yl]amino]-3-pyridinyl]imidazolidin-2-one
CID 142612116
(8aR)-3-(methylideneamino)-4-[(E)-2-[[5-methyl-8-(2-oxopyrrolidin-1-yl)-5H-chromeno[4,3-c]pyridin-3-yl]amino]prop-1-enyl]-1,7,8,8a-tetrahydropyrrolo[2,1-c][1,4]oxazin-6-one
CID 166717050
1-[4-(6-amino-3-pyridinyl)phenyl]pyrrolidin-2-one
CID 142612606
1-[4-(2-oxopyrrolidin-1-yl)phenyl]pyrrolidin-2-one
CID 822790
1-(2-methyl-4-pyridinyl)pyrrolidin-2-one
CID 70517179
(6S)-12-[[9-fluoro-5-methyl-8-(2-oxopyrrolidin-1-yl)-5H-chromeno[4,3-c]pyridin-3-yl]amino]-4,4-dimethyl-8-oxa-2,10-diazatricyclo[7.4.0.02,6]trideca-1(9),10,12-trien-3-one
CID 142612038
1-[4-(4-acetyl-6-chloro-3-pyridinyl)-3-fluorophenyl]pyrrolidin-2-one
CID 142612200

Frequently Asked Questions

What is the IUPAC name of 1-(3-amino-5-methyl-5H-chromeno[4,3-c]pyridin-8-yl)pyrrolidin-2-one?
The IUPAC name of 1-(3-amino-5-methyl-5H-chromeno[4,3-c]pyridin-8-yl)pyrrolidin-2-one (CID 142611989) is 1-(3-amino-5-methyl-5H-chromeno[4,3-c]pyridin-8-yl)pyrrolidin-2-one.
What is the SMILES notation for 1-(3-amino-5-methyl-5H-chromeno[4,3-c]pyridin-8-yl)pyrrolidin-2-one?
The canonical SMILES for 1-(3-amino-5-methyl-5H-chromeno[4,3-c]pyridin-8-yl)pyrrolidin-2-one is CC1Oc2cc(N3CCCC3=O)ccc2-c2cnc(N)cc21.
What is the InChIKey of 1-(3-amino-5-methyl-5H-chromeno[4,3-c]pyridin-8-yl)pyrrolidin-2-one?
The InChIKey is SQOQDQCSZASEHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O2/c1-10-13-8-16(18)19-9-14(13)12-5-4-11(7-15(12)22-10)20-6-2-3-17(20)21/h4-5,7-10H,2-3,6H2,1H3,(H2,18,19).
What are the key properties of 1-(3-amino-5-methyl-5H-chromeno[4,3-c]pyridin-8-yl)pyrrolidin-2-one?
1-(3-amino-5-methyl-5H-chromeno[4,3-c]pyridin-8-yl)pyrrolidin-2-one has a molecular weight of 295.34 g/mol, XLogP of 2.91, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-amino-5-methyl-5H-chromeno[4,3-c]pyridin-8-yl)pyrrolidin-2-one is sourced from PubChem (CID 142611989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).