N-(7,8-dihydro-1,6-naphthyridin-5-yl)formamide

C9H9N3O — CID 174977558

IUPACN-(7,8-dihydro-1,6-naphthyridin-5-yl)formamide
SMILESO=CNC1=NCCc2ncccc21
InChIInChI=1S/C9H9N3O/c13-6-12-9-7-2-1-4-10-8(7)3-5-11-9/h1-2,4,6H,3,5H2,(H,11,12,13)
InChIKeyKBSZLOWRTNHWQY-UHFFFAOYSA-N
MW175.19 g/mol
LogP0.13
Rot. Bonds1

About N-(7,8-dihydro-1,6-naphthyridin-5-yl)formamide

N-(7,8-dihydro-1,6-naphthyridin-5-yl)formamide (PubChem CID 174977558) has the molecular formula C9H9N3O and a molecular weight of 175.19 g/mol. Its IUPAC name is N-(7,8-dihydro-1,6-naphthyridin-5-yl)formamide.

Molecular Properties

Compound NameN-(7,8-dihydro-1,6-naphthyridin-5-yl)formamide
PubChem CID174977558
Molecular FormulaC9H9N3O
Molecular Weight175.19 g/mol
Exact Mass175.07
IUPAC NameN-(7,8-dihydro-1,6-naphthyridin-5-yl)formamide
SMILESO=CNC1=NCCc2ncccc21
InChIInChI=1S/C9H9N3O/c13-6-12-9-7-2-1-4-10-8(7)3-5-11-9/h1-2,4,6H,3,5H2,(H,11,12,13)
InChIKeyKBSZLOWRTNHWQY-UHFFFAOYSA-N
XLogP0.13
TPSA54.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.19
LogP ≤ 50.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5,6-dihydro-1,7-phenanthroline
CID 69016308
6-fluoro-7,8-dihydro-6H-quinolin-5-one
CID 166885117
6-(dimethylaminomethylidene)-7,8-dihydroquinolin-5-one
CID 54008411
5-ethylidene-7,8-dihydro-6H-quinoline
CID 164582583
cyclopropane;N-pyridin-2-ylformamide
CID 170968327
11,12-dihydro-[1]benzoxocino[4,3-b]pyridin-5-one
CID 165346789
5,6,7,8-tetrahydroquinoline-5-carbaldehyde
CID 174393645
N-[4-chloro-2-(2-chloro-3-pyridinyl)phenyl]formamide
CID 151611576
2-azabicyclo[4.1.0]hepta-1(6),2,4-triene;formic acid
CID 174744482
ethane;5-ethenyl-7,8-dihydroquinoline
CID 177360263
2-formamidopyridine-3-carboxylic acid
CID 54137252
ethyl (2E)-2-(6,7-dihydrocyclopenta[b]pyridin-5-ylidene)acetate
CID 146584592

Frequently Asked Questions

What is the IUPAC name of N-(7,8-dihydro-1,6-naphthyridin-5-yl)formamide?
The IUPAC name of N-(7,8-dihydro-1,6-naphthyridin-5-yl)formamide (CID 174977558) is N-(7,8-dihydro-1,6-naphthyridin-5-yl)formamide.
What is the SMILES notation for N-(7,8-dihydro-1,6-naphthyridin-5-yl)formamide?
The canonical SMILES for N-(7,8-dihydro-1,6-naphthyridin-5-yl)formamide is O=CNC1=NCCc2ncccc21.
What is the InChIKey of N-(7,8-dihydro-1,6-naphthyridin-5-yl)formamide?
The InChIKey is KBSZLOWRTNHWQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3O/c13-6-12-9-7-2-1-4-10-8(7)3-5-11-9/h1-2,4,6H,3,5H2,(H,11,12,13).
What are the key properties of N-(7,8-dihydro-1,6-naphthyridin-5-yl)formamide?
N-(7,8-dihydro-1,6-naphthyridin-5-yl)formamide has a molecular weight of 175.19 g/mol, XLogP of 0.13, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(7,8-dihydro-1,6-naphthyridin-5-yl)formamide is sourced from PubChem (CID 174977558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).