6-N-(2-aminoethyl)-1H-indazole-5,6-diamine

C9H13N5 — CID 107490038

IUPAC6-N-(2-aminoethyl)-1H-indazole-5,6-diamine
SMILESNCCNc1cc2[nH]ncc2cc1N
InChIInChI=1S/C9H13N5/c10-1-2-12-9-4-8-6(3-7(9)11)5-13-14-8/h3-5,12H,1-2,10-11H2,(H,13,14)
InChIKeyUEZMGLDTBLTLSN-UHFFFAOYSA-N
MW191.24 g/mol
LogP0.52
Rot. Bonds3

About 6-N-(2-aminoethyl)-1H-indazole-5,6-diamine

6-N-(2-aminoethyl)-1H-indazole-5,6-diamine (PubChem CID 107490038) has the molecular formula C9H13N5 and a molecular weight of 191.24 g/mol. Its IUPAC name is 6-N-(2-aminoethyl)-1H-indazole-5,6-diamine.

Molecular Properties

Compound Name6-N-(2-aminoethyl)-1H-indazole-5,6-diamine
PubChem CID107490038
Molecular FormulaC9H13N5
Molecular Weight191.24 g/mol
Exact Mass191.12
IUPAC Name6-N-(2-aminoethyl)-1H-indazole-5,6-diamine
SMILESNCCNc1cc2[nH]ncc2cc1N
InChIInChI=1S/C9H13N5/c10-1-2-12-9-4-8-6(3-7(9)11)5-13-14-8/h3-5,12H,1-2,10-11H2,(H,13,14)
InChIKeyUEZMGLDTBLTLSN-UHFFFAOYSA-N
XLogP0.52
TPSA92.75 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.24
LogP ≤ 50.52
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-[(5-amino-1H-indazol-6-yl)amino]-N-tert-butylpropanamide
CID 107490924
3-[(5-amino-1H-indazol-6-yl)amino]-N-propan-2-ylpropanamide
CID 107490922
6-N-(3-phenoxypropyl)-1H-indazole-5,6-diamine
CID 107490023
6-N-tert-butyl-1H-indazole-5,6-diamine
CID 107488480
4-[[(5-amino-1H-indazol-6-yl)amino]methyl]cyclohexan-1-ol
CID 106120243
6-N-[(5-bromo-2-fluorophenyl)methyl]-1H-indazole-5,6-diamine
CID 107489222
6-N-(2-cyclopropylpropyl)-1H-indazole-5,6-diamine
CID 107490998
6-N-[(1-propan-2-ylcyclopropyl)methyl]-1H-indazole-5,6-diamine
CID 114114758
4-[[(5-amino-1H-indazol-6-yl)amino]methyl]benzonitrile
CID 107489977
4-[(5-amino-1H-indazol-6-yl)amino]cyclohexan-1-ol
CID 107488320
2-[(5-amino-1H-indazol-6-yl)amino]cycloheptan-1-ol
CID 107490875
6-N-(2,3-dihydro-1H-inden-2-yl)-1H-indazole-5,6-diamine
CID 107844682

Frequently Asked Questions

What is the IUPAC name of 6-N-(2-aminoethyl)-1H-indazole-5,6-diamine?
The IUPAC name of 6-N-(2-aminoethyl)-1H-indazole-5,6-diamine (CID 107490038) is 6-N-(2-aminoethyl)-1H-indazole-5,6-diamine.
What is the SMILES notation for 6-N-(2-aminoethyl)-1H-indazole-5,6-diamine?
The canonical SMILES for 6-N-(2-aminoethyl)-1H-indazole-5,6-diamine is NCCNc1cc2[nH]ncc2cc1N.
What is the InChIKey of 6-N-(2-aminoethyl)-1H-indazole-5,6-diamine?
The InChIKey is UEZMGLDTBLTLSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N5/c10-1-2-12-9-4-8-6(3-7(9)11)5-13-14-8/h3-5,12H,1-2,10-11H2,(H,13,14).
What are the key properties of 6-N-(2-aminoethyl)-1H-indazole-5,6-diamine?
6-N-(2-aminoethyl)-1H-indazole-5,6-diamine has a molecular weight of 191.24 g/mol, XLogP of 0.52, 3 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-(2-aminoethyl)-1H-indazole-5,6-diamine is sourced from PubChem (CID 107490038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).