N'-(5,7-dimethyl-3,4-dihydronaphthalen-1-yl)pyridine-3-carbohydrazide

C18H19N3O — CID 2451304

IUPACN'-(5,7-dimethyl-3,4-dihydronaphthalen-1-yl)pyridine-3-carbohydrazide
SMILESCc1cc(C)c2c(c1)C(NNC(=O)c1cccnc1)=CCC2
InChIInChI=1S/C18H19N3O/c1-12-9-13(2)15-6-3-7-17(16(15)10-12)20-21-18(22)14-5-4-8-19-11-14/h4-5,7-11,20H,3,6H2,1-2H3,(H,21,22)
InChIKeyMQTLJTKYTDHDHJ-UHFFFAOYSA-N
MW293.37 g/mol
LogP2.92
Rot. Bonds3

About N'-(5,7-dimethyl-3,4-dihydronaphthalen-1-yl)pyridine-3-carbohydrazide

N'-(5,7-dimethyl-3,4-dihydronaphthalen-1-yl)pyridine-3-carbohydrazide (PubChem CID 2451304) has the molecular formula C18H19N3O and a molecular weight of 293.37 g/mol. Its IUPAC name is N'-(5,7-dimethyl-3,4-dihydronaphthalen-1-yl)pyridine-3-carbohydrazide.

Molecular Properties

Compound NameN'-(5,7-dimethyl-3,4-dihydronaphthalen-1-yl)pyridine-3-carbohydrazide
PubChem CID2451304
Molecular FormulaC18H19N3O
Molecular Weight293.37 g/mol
Exact Mass293.15
IUPAC NameN'-(5,7-dimethyl-3,4-dihydronaphthalen-1-yl)pyridine-3-carbohydrazide
SMILESCc1cc(C)c2c(c1)C(NNC(=O)c1cccnc1)=CCC2
InChIInChI=1S/C18H19N3O/c1-12-9-13(2)15-6-3-7-17(16(15)10-12)20-21-18(22)14-5-4-8-19-11-14/h4-5,7-11,20H,3,6H2,1-2H3,(H,21,22)
InChIKeyMQTLJTKYTDHDHJ-UHFFFAOYSA-N
XLogP2.92
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-(2-amino-4,6-dimethylphenyl)pyridine-3-carboxamide
CID 56773226
N'-pyridin-2-ylpyridine-3-carbohydrazide
CID 69416476
N'-(2,4,6-trichlorophenyl)pyridine-3-carbohydrazide
CID 47099649
N-methylpyridine-3-carboxamide chloride
CID 20976730
N'-[5-amino-6-[(3-methyl-2-pyridinyl)amino]pyrimidin-4-yl]pyridine-3-carbohydrazide
CID 19144647
3-methyl-4-oxo-N'-(pyridine-3-carbonyl)-1,5,6,7-tetrahydroindole-2-carbohydrazide
CID 35016480
2,3-dimethyl-N'-(pyridine-3-carbonyl)quinoxaline-6-carbohydrazide
CID 39966213
N-(4-iodo-2,5-dimethylphenyl)pyridine-3-carboxamide
CID 2209331
trimethyl-(pyridine-3-carbonylamino)azanium
CID 177120197
6-methyl-1-(pyridine-3-carbonyl)-2,3-dihydroquinolin-4-one
CID 110634863
N'-[5-amino-6-[2-(pyridine-3-carbonyl)hydrazinyl]pyrimidin-4-yl]pyridine-3-carbohydrazide
CID 19151889
1-methyl-3-(pyridine-3-carbonylamino)(14C)thiourea
CID 25193705

Frequently Asked Questions

What is the IUPAC name of N'-(5,7-dimethyl-3,4-dihydronaphthalen-1-yl)pyridine-3-carbohydrazide?
The IUPAC name of N'-(5,7-dimethyl-3,4-dihydronaphthalen-1-yl)pyridine-3-carbohydrazide (CID 2451304) is N'-(5,7-dimethyl-3,4-dihydronaphthalen-1-yl)pyridine-3-carbohydrazide.
What is the SMILES notation for N'-(5,7-dimethyl-3,4-dihydronaphthalen-1-yl)pyridine-3-carbohydrazide?
The canonical SMILES for N'-(5,7-dimethyl-3,4-dihydronaphthalen-1-yl)pyridine-3-carbohydrazide is Cc1cc(C)c2c(c1)C(NNC(=O)c1cccnc1)=CCC2.
What is the InChIKey of N'-(5,7-dimethyl-3,4-dihydronaphthalen-1-yl)pyridine-3-carbohydrazide?
The InChIKey is MQTLJTKYTDHDHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O/c1-12-9-13(2)15-6-3-7-17(16(15)10-12)20-21-18(22)14-5-4-8-19-11-14/h4-5,7-11,20H,3,6H2,1-2H3,(H,21,22).
What are the key properties of N'-(5,7-dimethyl-3,4-dihydronaphthalen-1-yl)pyridine-3-carbohydrazide?
N'-(5,7-dimethyl-3,4-dihydronaphthalen-1-yl)pyridine-3-carbohydrazide has a molecular weight of 293.37 g/mol, XLogP of 2.92, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(5,7-dimethyl-3,4-dihydronaphthalen-1-yl)pyridine-3-carbohydrazide is sourced from PubChem (CID 2451304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).