4-[2-amino-5-[3-(dimethylamino)phenyl]-3-pyridinyl]phenol

C19H19N3O — CID 24821076

IUPAC4-[2-amino-5-[3-(dimethylamino)phenyl]-3-pyridinyl]phenol
SMILESCN(C)c1cccc(-c2cnc(N)c(-c3ccc(O)cc3)c2)c1
InChIInChI=1S/C19H19N3O/c1-22(2)16-5-3-4-14(10-16)15-11-18(19(20)21-12-15)13-6-8-17(23)9-7-13/h3-12,23H,1-2H3,(H2,20,21)
InChIKeyMPNJYRVFEORUGN-UHFFFAOYSA-N
MW305.38 g/mol
LogP3.77
Rot. Bonds3

About 4-[2-amino-5-[3-(dimethylamino)phenyl]-3-pyridinyl]phenol

4-[2-amino-5-[3-(dimethylamino)phenyl]-3-pyridinyl]phenol (PubChem CID 24821076) has the molecular formula C19H19N3O and a molecular weight of 305.38 g/mol. Its IUPAC name is 4-[2-amino-5-[3-(dimethylamino)phenyl]-3-pyridinyl]phenol.

Molecular Properties

Compound Name4-[2-amino-5-[3-(dimethylamino)phenyl]-3-pyridinyl]phenol
PubChem CID24821076
Molecular FormulaC19H19N3O
Molecular Weight305.38 g/mol
Exact Mass305.15
IUPAC Name4-[2-amino-5-[3-(dimethylamino)phenyl]-3-pyridinyl]phenol
SMILESCN(C)c1cccc(-c2cnc(N)c(-c3ccc(O)cc3)c2)c1
InChIInChI=1S/C19H19N3O/c1-22(2)16-5-3-4-14(10-16)15-11-18(19(20)21-12-15)13-6-8-17(23)9-7-13/h3-12,23H,1-2H3,(H2,20,21)
InChIKeyMPNJYRVFEORUGN-UHFFFAOYSA-N
XLogP3.77
TPSA62.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 53.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[2-amino-5-[3-(dimethylamino)phenyl]-3-pyridinyl]phenol?
The IUPAC name of 4-[2-amino-5-[3-(dimethylamino)phenyl]-3-pyridinyl]phenol (CID 24821076) is 4-[2-amino-5-[3-(dimethylamino)phenyl]-3-pyridinyl]phenol.
What is the SMILES notation for 4-[2-amino-5-[3-(dimethylamino)phenyl]-3-pyridinyl]phenol?
The canonical SMILES for 4-[2-amino-5-[3-(dimethylamino)phenyl]-3-pyridinyl]phenol is CN(C)c1cccc(-c2cnc(N)c(-c3ccc(O)cc3)c2)c1.
What is the InChIKey of 4-[2-amino-5-[3-(dimethylamino)phenyl]-3-pyridinyl]phenol?
The InChIKey is MPNJYRVFEORUGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O/c1-22(2)16-5-3-4-14(10-16)15-11-18(19(20)21-12-15)13-6-8-17(23)9-7-13/h3-12,23H,1-2H3,(H2,20,21).
What are the key properties of 4-[2-amino-5-[3-(dimethylamino)phenyl]-3-pyridinyl]phenol?
4-[2-amino-5-[3-(dimethylamino)phenyl]-3-pyridinyl]phenol has a molecular weight of 305.38 g/mol, XLogP of 3.77, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-amino-5-[3-(dimethylamino)phenyl]-3-pyridinyl]phenol is sourced from PubChem (CID 24821076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).