4-[3-amino-5-(2-amino-4-pyridinyl)-1H-indazol-7-yl]phenol

C18H15N5O — CID 170352094

IUPAC4-[3-amino-5-(2-amino-4-pyridinyl)-1H-indazol-7-yl]phenol
SMILESNc1cc(-c2cc(-c3ccc(O)cc3)c3[nH]nc(N)c3c2)ccn1
InChIInChI=1S/C18H15N5O/c19-16-9-11(5-6-21-16)12-7-14(10-1-3-13(24)4-2-10)17-15(8-12)18(20)23-22-17/h1-9,24H,(H2,19,21)(H3,20,22,23)
InChIKeySOMRNFUQIJDBGM-UHFFFAOYSA-N
MW317.35 g/mol
LogP3.16
Rot. Bonds2

About 4-[3-amino-5-(2-amino-4-pyridinyl)-1H-indazol-7-yl]phenol

4-[3-amino-5-(2-amino-4-pyridinyl)-1H-indazol-7-yl]phenol (PubChem CID 170352094) has the molecular formula C18H15N5O and a molecular weight of 317.35 g/mol. Its IUPAC name is 4-[3-amino-5-(2-amino-4-pyridinyl)-1H-indazol-7-yl]phenol.

Molecular Properties

Compound Name4-[3-amino-5-(2-amino-4-pyridinyl)-1H-indazol-7-yl]phenol
PubChem CID170352094
Molecular FormulaC18H15N5O
Molecular Weight317.35 g/mol
Exact Mass317.13
IUPAC Name4-[3-amino-5-(2-amino-4-pyridinyl)-1H-indazol-7-yl]phenol
SMILESNc1cc(-c2cc(-c3ccc(O)cc3)c3[nH]nc(N)c3c2)ccn1
InChIInChI=1S/C18H15N5O/c19-16-9-11(5-6-21-16)12-7-14(10-1-3-13(24)4-2-10)17-15(8-12)18(20)23-22-17/h1-9,24H,(H2,19,21)(H3,20,22,23)
InChIKeySOMRNFUQIJDBGM-UHFFFAOYSA-N
XLogP3.16
TPSA113.84 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.35
LogP ≤ 53.16
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Related Compounds

4-[3-amino-5-(2-amino-4-pyridinyl)-1H-indazol-7-yl]benzenesulfonamide
CID 170352013
5-(2-amino-4-pyridinyl)-7-(3-fluorophenyl)-1H-indazol-3-amine
CID 170351905
3-[3-amino-5-(2-amino-4-pyridinyl)-1H-indazol-7-yl]benzamide
CID 170352278
methyl N-[4-[3-amino-7-[4-(difluoromethyl)phenyl]-1H-indazol-5-yl]-2-pyridinyl]carbamate
CID 170422415
4-[3-amino-6-(4-hydroxyphenyl)-1H-indazol-5-yl]phenol
CID 135848029
5-(2-amino-4-pyridinyl)-7-[2-(oxan-4-yl)ethynyl]-1H-indazol-3-amine
CID 170352181
[4-(2-amino-4-pyridinyl)phenyl]methanol
CID 50976559
N-[4-(3-amino-7-bromo-1H-indazol-5-yl)-2-pyridinyl]cyclopropanecarboxamide
CID 170352157
4-(3-amino-5-bromo-1H-indazol-6-yl)phenol
CID 135848027
4-[4-(1H-pyrazol-5-yl)phenyl]pyridin-2-amine
CID 50969031
N-[4-(3-amino-7-bromo-1H-indazol-5-yl)-2-pyridinyl]-3-methylbutanamide
CID 170352373
1-[4-(3-amino-7-bromo-1H-indazol-5-yl)-2-pyridinyl]-3-ethylurea
CID 170352441

Frequently Asked Questions

What is the IUPAC name of 4-[3-amino-5-(2-amino-4-pyridinyl)-1H-indazol-7-yl]phenol?
The IUPAC name of 4-[3-amino-5-(2-amino-4-pyridinyl)-1H-indazol-7-yl]phenol (CID 170352094) is 4-[3-amino-5-(2-amino-4-pyridinyl)-1H-indazol-7-yl]phenol.
What is the SMILES notation for 4-[3-amino-5-(2-amino-4-pyridinyl)-1H-indazol-7-yl]phenol?
The canonical SMILES for 4-[3-amino-5-(2-amino-4-pyridinyl)-1H-indazol-7-yl]phenol is Nc1cc(-c2cc(-c3ccc(O)cc3)c3[nH]nc(N)c3c2)ccn1.
What is the InChIKey of 4-[3-amino-5-(2-amino-4-pyridinyl)-1H-indazol-7-yl]phenol?
The InChIKey is SOMRNFUQIJDBGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N5O/c19-16-9-11(5-6-21-16)12-7-14(10-1-3-13(24)4-2-10)17-15(8-12)18(20)23-22-17/h1-9,24H,(H2,19,21)(H3,20,22,23).
What are the key properties of 4-[3-amino-5-(2-amino-4-pyridinyl)-1H-indazol-7-yl]phenol?
4-[3-amino-5-(2-amino-4-pyridinyl)-1H-indazol-7-yl]phenol has a molecular weight of 317.35 g/mol, XLogP of 3.16, 2 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-amino-5-(2-amino-4-pyridinyl)-1H-indazol-7-yl]phenol is sourced from PubChem (CID 170352094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).