10-(methylamino)-1,3,4,6,7,8,9,10-octahydropyrano[4,3-c]quinolin-5-one

C13H18N2O2 — CID 156504897

IUPAC10-(methylamino)-1,3,4,6,7,8,9,10-octahydropyrano[4,3-c]quinolin-5-one
SMILESCNC1CCCc2[nH]c(=O)c3c(c21)COCC3
InChIInChI=1S/C13H18N2O2/c1-14-10-3-2-4-11-12(10)9-7-17-6-5-8(9)13(16)15-11/h10,14H,2-7H2,1H3,(H,15,16)
InChIKeyFPNABLWXZBMZBU-UHFFFAOYSA-N
MW234.30 g/mol
LogP1.04
Rot. Bonds1

About 10-(methylamino)-1,3,4,6,7,8,9,10-octahydropyrano[4,3-c]quinolin-5-one

10-(methylamino)-1,3,4,6,7,8,9,10-octahydropyrano[4,3-c]quinolin-5-one (PubChem CID 156504897) has the molecular formula C13H18N2O2 and a molecular weight of 234.30 g/mol. Its IUPAC name is 10-(methylamino)-1,3,4,6,7,8,9,10-octahydropyrano[4,3-c]quinolin-5-one.

Molecular Properties

Compound Name10-(methylamino)-1,3,4,6,7,8,9,10-octahydropyrano[4,3-c]quinolin-5-one
PubChem CID156504897
Molecular FormulaC13H18N2O2
Molecular Weight234.30 g/mol
Exact Mass234.14
IUPAC Name10-(methylamino)-1,3,4,6,7,8,9,10-octahydropyrano[4,3-c]quinolin-5-one
SMILESCNC1CCCc2[nH]c(=O)c3c(c21)COCC3
InChIInChI=1S/C13H18N2O2/c1-14-10-3-2-4-11-12(10)9-7-17-6-5-8(9)13(16)15-11/h10,14H,2-7H2,1H3,(H,15,16)
InChIKeyFPNABLWXZBMZBU-UHFFFAOYSA-N
XLogP1.04
TPSA54.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 51.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 10-(methylamino)-1,3,4,6,7,8,9,10-octahydropyrano[4,3-c]quinolin-5-one with MolForge

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Launch Full Analysis

Related Compounds

11-oxa-7-azatricyclo[7.4.0.02,6]trideca-1(9),2(6)-dien-8-one
CID 105444954
4,12-dioxa-9-azatricyclo[8.4.0.02,7]tetradeca-1(10),2(7)-diene-8,14-dione
CID 156504665
N-methyl-2,3,4,9-tetrahydro-1H-carbazol-4-amine
CID 65333308
(5S)-5-(methylamino)-5,6,7,8-tetrahydro-1H-quinolin-2-one
CID 89053172
N,7-dimethyl-2,3,4,9-tetrahydro-1H-carbazol-4-amine
CID 84740064
6-methoxy-N,8-dimethyl-2,3,4,9-tetrahydro-1H-carbazol-4-amine
CID 84741634
6-cyclohexyl-1,3,4,7-tetrahydropyrano[3,4-c]pyridin-8-one
CID 141123603
N-methyl-6-propan-2-yl-2,3,4,9-tetrahydro-1H-carbazol-4-amine
CID 84741422
3-ethyl-N-methyl-4,5,6,7-tetrahydro-1H-indazol-4-amine
CID 83861924
2-(oxan-4-yl)-3,5,7,8-tetrahydropyrano[4,3-d]pyrimidin-4-one
CID 136696313
N,5,7-trimethyl-2,3,4,9-tetrahydro-1H-carbazol-1-amine
CID 65333320
2-(4-propan-2-ylcyclohexyl)-3,5,7,8-tetrahydropyrano[4,3-d]pyrimidin-4-one
CID 136696365

Frequently Asked Questions

What is the IUPAC name of 10-(methylamino)-1,3,4,6,7,8,9,10-octahydropyrano[4,3-c]quinolin-5-one?
The IUPAC name of 10-(methylamino)-1,3,4,6,7,8,9,10-octahydropyrano[4,3-c]quinolin-5-one (CID 156504897) is 10-(methylamino)-1,3,4,6,7,8,9,10-octahydropyrano[4,3-c]quinolin-5-one.
What is the SMILES notation for 10-(methylamino)-1,3,4,6,7,8,9,10-octahydropyrano[4,3-c]quinolin-5-one?
The canonical SMILES for 10-(methylamino)-1,3,4,6,7,8,9,10-octahydropyrano[4,3-c]quinolin-5-one is CNC1CCCc2[nH]c(=O)c3c(c21)COCC3.
What is the InChIKey of 10-(methylamino)-1,3,4,6,7,8,9,10-octahydropyrano[4,3-c]quinolin-5-one?
The InChIKey is FPNABLWXZBMZBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O2/c1-14-10-3-2-4-11-12(10)9-7-17-6-5-8(9)13(16)15-11/h10,14H,2-7H2,1H3,(H,15,16).
What are the key properties of 10-(methylamino)-1,3,4,6,7,8,9,10-octahydropyrano[4,3-c]quinolin-5-one?
10-(methylamino)-1,3,4,6,7,8,9,10-octahydropyrano[4,3-c]quinolin-5-one has a molecular weight of 234.30 g/mol, XLogP of 1.04, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 10-(methylamino)-1,3,4,6,7,8,9,10-octahydropyrano[4,3-c]quinolin-5-one is sourced from PubChem (CID 156504897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).