[3-[3-[[(2-amino-3-pyridinyl)amino]methyl]phenyl]phenyl]methanol

C19H19N3O — CID 11565745

IUPAC[3-[3-[[(2-amino-3-pyridinyl)amino]methyl]phenyl]phenyl]methanol
SMILESNc1ncccc1NCc1cccc(-c2cccc(CO)c2)c1
InChIInChI=1S/C19H19N3O/c20-19-18(8-3-9-21-19)22-12-14-4-1-6-16(10-14)17-7-2-5-15(11-17)13-23/h1-11,22-23H,12-13H2,(H2,20,21)
InChIKeyYTYZHYMYVNUGAC-UHFFFAOYSA-N
MW305.38 g/mol
LogP3.44
Rot. Bonds5

About [3-[3-[[(2-amino-3-pyridinyl)amino]methyl]phenyl]phenyl]methanol

[3-[3-[[(2-amino-3-pyridinyl)amino]methyl]phenyl]phenyl]methanol (PubChem CID 11565745) has the molecular formula C19H19N3O and a molecular weight of 305.38 g/mol. Its IUPAC name is [3-[3-[[(2-amino-3-pyridinyl)amino]methyl]phenyl]phenyl]methanol.

Molecular Properties

Compound Name[3-[3-[[(2-amino-3-pyridinyl)amino]methyl]phenyl]phenyl]methanol
PubChem CID11565745
Molecular FormulaC19H19N3O
Molecular Weight305.38 g/mol
Exact Mass305.15
IUPAC Name[3-[3-[[(2-amino-3-pyridinyl)amino]methyl]phenyl]phenyl]methanol
SMILESNc1ncccc1NCc1cccc(-c2cccc(CO)c2)c1
InChIInChI=1S/C19H19N3O/c20-19-18(8-3-9-21-19)22-12-14-4-1-6-16(10-14)17-7-2-5-15(11-17)13-23/h1-11,22-23H,12-13H2,(H2,20,21)
InChIKeyYTYZHYMYVNUGAC-UHFFFAOYSA-N
XLogP3.44
TPSA71.17 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 53.44
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [3-[3-[[(2-amino-3-pyridinyl)amino]methyl]phenyl]phenyl]methanol?
The IUPAC name of [3-[3-[[(2-amino-3-pyridinyl)amino]methyl]phenyl]phenyl]methanol (CID 11565745) is [3-[3-[[(2-amino-3-pyridinyl)amino]methyl]phenyl]phenyl]methanol.
What is the SMILES notation for [3-[3-[[(2-amino-3-pyridinyl)amino]methyl]phenyl]phenyl]methanol?
The canonical SMILES for [3-[3-[[(2-amino-3-pyridinyl)amino]methyl]phenyl]phenyl]methanol is Nc1ncccc1NCc1cccc(-c2cccc(CO)c2)c1.
What is the InChIKey of [3-[3-[[(2-amino-3-pyridinyl)amino]methyl]phenyl]phenyl]methanol?
The InChIKey is YTYZHYMYVNUGAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O/c20-19-18(8-3-9-21-19)22-12-14-4-1-6-16(10-14)17-7-2-5-15(11-17)13-23/h1-11,22-23H,12-13H2,(H2,20,21).
What are the key properties of [3-[3-[[(2-amino-3-pyridinyl)amino]methyl]phenyl]phenyl]methanol?
[3-[3-[[(2-amino-3-pyridinyl)amino]methyl]phenyl]phenyl]methanol has a molecular weight of 305.38 g/mol, XLogP of 3.44, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[3-[[(2-amino-3-pyridinyl)amino]methyl]phenyl]phenyl]methanol is sourced from PubChem (CID 11565745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).