6-propan-2-ylbenzo[c][2,7]naphthyridin-5-one

C15H14N2O — CID 154465601

IUPAC6-propan-2-ylbenzo[c][2,7]naphthyridin-5-one
SMILESCC(C)n1c(=O)c2cnccc2c2ccccc21
InChIInChI=1S/C15H14N2O/c1-10(2)17-14-6-4-3-5-12(14)11-7-8-16-9-13(11)15(17)18/h3-10H,1-2H3
InChIKeyYJSCRLPULBFKOX-UHFFFAOYSA-N
MW238.29 g/mol
LogP3.13
Rot. Bonds1

About 6-propan-2-ylbenzo[c][2,7]naphthyridin-5-one

6-propan-2-ylbenzo[c][2,7]naphthyridin-5-one (PubChem CID 154465601) has the molecular formula C15H14N2O and a molecular weight of 238.29 g/mol. Its IUPAC name is 6-propan-2-ylbenzo[c][2,7]naphthyridin-5-one.

Molecular Properties

Compound Name6-propan-2-ylbenzo[c][2,7]naphthyridin-5-one
PubChem CID154465601
Molecular FormulaC15H14N2O
Molecular Weight238.29 g/mol
Exact Mass238.11
IUPAC Name6-propan-2-ylbenzo[c][2,7]naphthyridin-5-one
SMILESCC(C)n1c(=O)c2cnccc2c2ccccc21
InChIInChI=1S/C15H14N2O/c1-10(2)17-14-6-4-3-5-12(14)11-7-8-16-9-13(11)15(17)18/h3-10H,1-2H3
InChIKeyYJSCRLPULBFKOX-UHFFFAOYSA-N
XLogP3.13
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 53.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Related Compounds

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CID 153420870
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CID 10727152
N-hydroxy-N-(1-pyrido[3,4-b]indol-9-ylethyl)acetamide
CID 58171417
9-pyrido[3,4-b]indol-9-ylpyrido[3,4-b]indole
CID 86059681
ethane;(2Z,4Z)-hexa-2,4-diene;9-propan-2-ylcarbazole
CID 165044718
4-azahexacyclo[12.12.0.02,7.08,13.015,20.021,26]hexacosa-1(14),2(7),3,5,8,10,12,15,17,19,21,23,25-tridecaene
CID 146641531
4-amino-1-propan-2-ylquinazolin-2-one
CID 156889369
tert-butyl N-[(2S)-4-methyl-1-(5-oxo-6-propan-2-ylbenzo[c][2,7]naphthyridin-8-yl)oxypentan-2-yl]carbamate
CID 86710313
3-iodo-2-methyl-1-propan-2-ylquinolin-4-one
CID 176548683
6-(3-triphenylen-2-ylphenyl)benzo[c][2,6]naphthyridin-5-one
CID 146302394
9-propan-2-yl-2-(9-propan-2-ylcarbazol-2-yl)carbazole
CID 170205010
9-methoxy-5-propan-2-ylcyclohepta[b]indol-6-one
CID 139810032

Frequently Asked Questions

What is the IUPAC name of 6-propan-2-ylbenzo[c][2,7]naphthyridin-5-one?
The IUPAC name of 6-propan-2-ylbenzo[c][2,7]naphthyridin-5-one (CID 154465601) is 6-propan-2-ylbenzo[c][2,7]naphthyridin-5-one.
What is the SMILES notation for 6-propan-2-ylbenzo[c][2,7]naphthyridin-5-one?
The canonical SMILES for 6-propan-2-ylbenzo[c][2,7]naphthyridin-5-one is CC(C)n1c(=O)c2cnccc2c2ccccc21.
What is the InChIKey of 6-propan-2-ylbenzo[c][2,7]naphthyridin-5-one?
The InChIKey is YJSCRLPULBFKOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O/c1-10(2)17-14-6-4-3-5-12(14)11-7-8-16-9-13(11)15(17)18/h3-10H,1-2H3.
What are the key properties of 6-propan-2-ylbenzo[c][2,7]naphthyridin-5-one?
6-propan-2-ylbenzo[c][2,7]naphthyridin-5-one has a molecular weight of 238.29 g/mol, XLogP of 3.13, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-propan-2-ylbenzo[c][2,7]naphthyridin-5-one is sourced from PubChem (CID 154465601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).