N-methyl-N-(methyldiazenyl)-3-pyridin-4-yl-1H-indazol-5-amine

C14H14N6 — CID 123594605

IUPACN-methyl-N-(methyldiazenyl)-3-pyridin-4-yl-1H-indazol-5-amine
SMILESC/N=N/N(C)c1ccc2[nH]nc(-c3ccncc3)c2c1
InChIInChI=1S/C14H14N6/c1-15-19-20(2)11-3-4-13-12(9-11)14(18-17-13)10-5-7-16-8-6-10/h3-9H,1-2H3,(H,17,18)/b19-15+
InChIKeyMFPIMNYZHWAKMJ-XDJHFCHBSA-N
MW266.31 g/mol
LogP3.06
Rot. Bonds3

About N-methyl-N-(methyldiazenyl)-3-pyridin-4-yl-1H-indazol-5-amine

N-methyl-N-(methyldiazenyl)-3-pyridin-4-yl-1H-indazol-5-amine (PubChem CID 123594605) has the molecular formula C14H14N6 and a molecular weight of 266.31 g/mol. Its IUPAC name is N-methyl-N-(methyldiazenyl)-3-pyridin-4-yl-1H-indazol-5-amine.

Molecular Properties

Compound NameN-methyl-N-(methyldiazenyl)-3-pyridin-4-yl-1H-indazol-5-amine
PubChem CID123594605
Molecular FormulaC14H14N6
Molecular Weight266.31 g/mol
Exact Mass266.13
IUPAC NameN-methyl-N-(methyldiazenyl)-3-pyridin-4-yl-1H-indazol-5-amine
SMILESC/N=N/N(C)c1ccc2[nH]nc(-c3ccncc3)c2c1
InChIInChI=1S/C14H14N6/c1-15-19-20(2)11-3-4-13-12(9-11)14(18-17-13)10-5-7-16-8-6-10/h3-9H,1-2H3,(H,17,18)/b19-15+
InChIKeyMFPIMNYZHWAKMJ-XDJHFCHBSA-N
XLogP3.06
TPSA69.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.31
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4-[(3-pyridin-4-yl-1H-indazol-5-yl)amino]benzonitrile
CID 166551342
3-(4-fluorophenyl)-N-methyl-1H-indazol-5-amine
CID 71190825
3-(4-methylphenyl)-1H-indazol-5-amine
CID 39218240
3-(4-methylphenyl)-5-(1H-1,2,4-triazol-5-yl)-1H-indazole
CID 22479813
N-[3,5-bis(trifluoromethyl)phenyl]-N-[3-(4-fluorophenyl)-1H-indazol-5-yl]formamide
CID 87828814
3-(4-fluorophenyl)-5-pyrimidin-4-yl-1H-indazole
CID 90732532
5-[4-(dimethylamino)phenyl]-1H-indazol-3-amine
CID 11637416
N,N-dimethyl-4-(6-nitro-1H-indazol-3-yl)aniline
CID 10286156
N,5-dimethyl-3-pyridin-4-yl-1H-pyrazol-4-amine
CID 116827006
N-[3-(4-fluorophenyl)-1H-indazol-5-yl]-N-(3-hydroxyphenyl)formamide
CID 87827054
6-pyridin-4-yl-1H-indazol-3-amine;hydrochloride
CID 53317179
N-[3-(4-fluorophenyl)-1H-indazol-5-yl]pyridine-4-carboxamide
CID 22479938

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(methyldiazenyl)-3-pyridin-4-yl-1H-indazol-5-amine?
The IUPAC name of N-methyl-N-(methyldiazenyl)-3-pyridin-4-yl-1H-indazol-5-amine (CID 123594605) is N-methyl-N-(methyldiazenyl)-3-pyridin-4-yl-1H-indazol-5-amine.
What is the SMILES notation for N-methyl-N-(methyldiazenyl)-3-pyridin-4-yl-1H-indazol-5-amine?
The canonical SMILES for N-methyl-N-(methyldiazenyl)-3-pyridin-4-yl-1H-indazol-5-amine is C/N=N/N(C)c1ccc2[nH]nc(-c3ccncc3)c2c1.
What is the InChIKey of N-methyl-N-(methyldiazenyl)-3-pyridin-4-yl-1H-indazol-5-amine?
The InChIKey is MFPIMNYZHWAKMJ-XDJHFCHBSA-N. The full InChI is InChI=1S/C14H14N6/c1-15-19-20(2)11-3-4-13-12(9-11)14(18-17-13)10-5-7-16-8-6-10/h3-9H,1-2H3,(H,17,18)/b19-15+.
What are the key properties of N-methyl-N-(methyldiazenyl)-3-pyridin-4-yl-1H-indazol-5-amine?
N-methyl-N-(methyldiazenyl)-3-pyridin-4-yl-1H-indazol-5-amine has a molecular weight of 266.31 g/mol, XLogP of 3.06, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(methyldiazenyl)-3-pyridin-4-yl-1H-indazol-5-amine is sourced from PubChem (CID 123594605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).