6-N-methyl-6-N-(pyridin-3-ylmethyl)-1H-indazole-5,6-diamine

C14H15N5 — CID 107488961

IUPAC6-N-methyl-6-N-(pyridin-3-ylmethyl)-1H-indazole-5,6-diamine
SMILESCN(Cc1cccnc1)c1cc2[nH]ncc2cc1N
InChIInChI=1S/C14H15N5/c1-19(9-10-3-2-4-16-7-10)14-6-13-11(5-12(14)15)8-17-18-13/h2-8H,9,15H2,1H3,(H,17,18)
InChIKeyZURHQMWPMODHSB-UHFFFAOYSA-N
MW253.31 g/mol
LogP2.18
Rot. Bonds3

About 6-N-methyl-6-N-(pyridin-3-ylmethyl)-1H-indazole-5,6-diamine

6-N-methyl-6-N-(pyridin-3-ylmethyl)-1H-indazole-5,6-diamine (PubChem CID 107488961) has the molecular formula C14H15N5 and a molecular weight of 253.31 g/mol. Its IUPAC name is 6-N-methyl-6-N-(pyridin-3-ylmethyl)-1H-indazole-5,6-diamine.

Molecular Properties

Compound Name6-N-methyl-6-N-(pyridin-3-ylmethyl)-1H-indazole-5,6-diamine
PubChem CID107488961
Molecular FormulaC14H15N5
Molecular Weight253.31 g/mol
Exact Mass253.13
IUPAC Name6-N-methyl-6-N-(pyridin-3-ylmethyl)-1H-indazole-5,6-diamine
SMILESCN(Cc1cccnc1)c1cc2[nH]ncc2cc1N
InChIInChI=1S/C14H15N5/c1-19(9-10-3-2-4-16-7-10)14-6-13-11(5-12(14)15)8-17-18-13/h2-8H,9,15H2,1H3,(H,17,18)
InChIKeyZURHQMWPMODHSB-UHFFFAOYSA-N
XLogP2.18
TPSA70.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.31
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-fluoro-5-iodo-2-N-methyl-2-N-(pyridin-3-ylmethyl)benzene-1,2-diamine
CID 66099878
4-fluoro-5-methoxy-1-N-methyl-1-N-(pyridin-3-ylmethyl)benzene-1,2-diamine
CID 55215876
6-N-methyl-6-N-(2-methylsulfanylethyl)-1H-indazole-5,6-diamine
CID 107490850
2-N,5-dimethyl-2-N-(pyridin-3-ylmethyl)pyridine-2,3-diamine
CID 66278201
5-N-methyl-5-N-(pyridin-3-ylmethyl)quinoline-5,8-diamine
CID 43563386
5-N-methyl-5-N-(pyridin-3-ylmethyl)pyridine-3,5-diamine
CID 104533006
6-(pyridin-3-ylmethyl)-1H-indazole
CID 174925312
N,4,6-trimethyl-N-(pyridin-3-ylmethyl)pyrimidin-2-amine
CID 78845350
3,5,6-trichloro-N-methyl-N-(pyridin-3-ylmethyl)pyridin-2-amine
CID 102750389
5-N-methyl-5-N-(pyridin-3-ylmethyl)-1,2-thiazole-3,5-diamine
CID 103360517
3-bromo-2-N-methyl-2-N-(pyridin-3-ylmethyl)pyridine-2,5-diamine
CID 79532611
5-amino-6-[methyl(pyridin-3-ylmethyl)amino]pyridine-3-carbonitrile
CID 103467604

Frequently Asked Questions

What is the IUPAC name of 6-N-methyl-6-N-(pyridin-3-ylmethyl)-1H-indazole-5,6-diamine?
The IUPAC name of 6-N-methyl-6-N-(pyridin-3-ylmethyl)-1H-indazole-5,6-diamine (CID 107488961) is 6-N-methyl-6-N-(pyridin-3-ylmethyl)-1H-indazole-5,6-diamine.
What is the SMILES notation for 6-N-methyl-6-N-(pyridin-3-ylmethyl)-1H-indazole-5,6-diamine?
The canonical SMILES for 6-N-methyl-6-N-(pyridin-3-ylmethyl)-1H-indazole-5,6-diamine is CN(Cc1cccnc1)c1cc2[nH]ncc2cc1N.
What is the InChIKey of 6-N-methyl-6-N-(pyridin-3-ylmethyl)-1H-indazole-5,6-diamine?
The InChIKey is ZURHQMWPMODHSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N5/c1-19(9-10-3-2-4-16-7-10)14-6-13-11(5-12(14)15)8-17-18-13/h2-8H,9,15H2,1H3,(H,17,18).
What are the key properties of 6-N-methyl-6-N-(pyridin-3-ylmethyl)-1H-indazole-5,6-diamine?
6-N-methyl-6-N-(pyridin-3-ylmethyl)-1H-indazole-5,6-diamine has a molecular weight of 253.31 g/mol, XLogP of 2.18, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-methyl-6-N-(pyridin-3-ylmethyl)-1H-indazole-5,6-diamine is sourced from PubChem (CID 107488961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).