4-[[(6-methyl-1H-indazol-4-yl)amino]methyl]phenol

C15H15N3O — CID 130335525

IUPAC4-[[(6-methyl-1H-indazol-4-yl)amino]methyl]phenol
SMILESCc1cc(NCc2ccc(O)cc2)c2cn[nH]c2c1
InChIInChI=1S/C15H15N3O/c1-10-6-14(13-9-17-18-15(13)7-10)16-8-11-2-4-12(19)5-3-11/h2-7,9,16,19H,8H2,1H3,(H,17,18)
InChIKeyOHIVPHGHZYQCGP-UHFFFAOYSA-N
MW253.31 g/mol
LogP3.19
Rot. Bonds3

About 4-[[(6-methyl-1H-indazol-4-yl)amino]methyl]phenol

4-[[(6-methyl-1H-indazol-4-yl)amino]methyl]phenol (PubChem CID 130335525) has the molecular formula C15H15N3O and a molecular weight of 253.31 g/mol. Its IUPAC name is 4-[[(6-methyl-1H-indazol-4-yl)amino]methyl]phenol.

Molecular Properties

Compound Name4-[[(6-methyl-1H-indazol-4-yl)amino]methyl]phenol
PubChem CID130335525
Molecular FormulaC15H15N3O
Molecular Weight253.31 g/mol
Exact Mass253.12
IUPAC Name4-[[(6-methyl-1H-indazol-4-yl)amino]methyl]phenol
SMILESCc1cc(NCc2ccc(O)cc2)c2cn[nH]c2c1
InChIInChI=1S/C15H15N3O/c1-10-6-14(13-9-17-18-15(13)7-10)16-8-11-2-4-12(19)5-3-11/h2-7,9,16,19H,8H2,1H3,(H,17,18)
InChIKeyOHIVPHGHZYQCGP-UHFFFAOYSA-N
XLogP3.19
TPSA60.94 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.31
LogP ≤ 53.19
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-[[(6-bromo-1H-indazol-4-yl)amino]methyl]phenyl]acetamide
CID 146669500
N-[(3-chlorophenyl)methyl]-1H-indazol-4-amine
CID 54865712
N-(1,3-benzodioxol-5-ylmethyl)-6-bromo-1H-indazol-4-amine
CID 146669427
N-[6-(4-hydroxyphenyl)-1H-indazol-4-yl]methanesulfonamide
CID 155544706
6-methyl-1H-indazole-4-carbohydrazide
CID 91582443
4-fluoro-6-methyl-1H-indazole
CID 24728805
4-[(2,5-difluoro-4-methylanilino)methyl]phenol
CID 103585182
6-bromo-N-[[3-(trifluoromethyl)phenyl]methyl]-1H-indazol-4-amine
CID 130335345
2-[3-[[(6-bromo-1H-indazol-4-yl)amino]methyl]anilino]acetic acid
CID 146669441
N-(1H-indol-5-ylmethyl)-1H-indazol-4-amine
CID 102910187
4-[[(5-amino-1H-indazol-6-yl)amino]methyl]benzonitrile
CID 107489977
4-[[(3,6-dimethylpyrazin-2-yl)amino]methyl]phenol
CID 113442355

Frequently Asked Questions

What is the IUPAC name of 4-[[(6-methyl-1H-indazol-4-yl)amino]methyl]phenol?
The IUPAC name of 4-[[(6-methyl-1H-indazol-4-yl)amino]methyl]phenol (CID 130335525) is 4-[[(6-methyl-1H-indazol-4-yl)amino]methyl]phenol.
What is the SMILES notation for 4-[[(6-methyl-1H-indazol-4-yl)amino]methyl]phenol?
The canonical SMILES for 4-[[(6-methyl-1H-indazol-4-yl)amino]methyl]phenol is Cc1cc(NCc2ccc(O)cc2)c2cn[nH]c2c1.
What is the InChIKey of 4-[[(6-methyl-1H-indazol-4-yl)amino]methyl]phenol?
The InChIKey is OHIVPHGHZYQCGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O/c1-10-6-14(13-9-17-18-15(13)7-10)16-8-11-2-4-12(19)5-3-11/h2-7,9,16,19H,8H2,1H3,(H,17,18).
What are the key properties of 4-[[(6-methyl-1H-indazol-4-yl)amino]methyl]phenol?
4-[[(6-methyl-1H-indazol-4-yl)amino]methyl]phenol has a molecular weight of 253.31 g/mol, XLogP of 3.19, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[(6-methyl-1H-indazol-4-yl)amino]methyl]phenol is sourced from PubChem (CID 130335525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).