N-[3-[6-amino-5-(4-hydroxyphenyl)-3-pyridinyl]phenyl]acetamide

C19H17N3O2 — CID 126672795

IUPACN-[3-[6-amino-5-(4-hydroxyphenyl)-3-pyridinyl]phenyl]acetamide
SMILESCC(=O)Nc1cccc(-c2cnc(N)c(-c3ccc(O)cc3)c2)c1
InChIInChI=1S/C19H17N3O2/c1-12(23)22-16-4-2-3-14(9-16)15-10-18(19(20)21-11-15)13-5-7-17(24)8-6-13/h2-11,24H,1H3,(H2,20,21)(H,22,23)
InChIKeyKBDXKGGQZIHXGB-UHFFFAOYSA-N
MW319.36 g/mol
LogP3.66
Rot. Bonds3

About N-[3-[6-amino-5-(4-hydroxyphenyl)-3-pyridinyl]phenyl]acetamide

N-[3-[6-amino-5-(4-hydroxyphenyl)-3-pyridinyl]phenyl]acetamide (PubChem CID 126672795) has the molecular formula C19H17N3O2 and a molecular weight of 319.36 g/mol. Its IUPAC name is N-[3-[6-amino-5-(4-hydroxyphenyl)-3-pyridinyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[3-[6-amino-5-(4-hydroxyphenyl)-3-pyridinyl]phenyl]acetamide
PubChem CID126672795
Molecular FormulaC19H17N3O2
Molecular Weight319.36 g/mol
Exact Mass319.13
IUPAC NameN-[3-[6-amino-5-(4-hydroxyphenyl)-3-pyridinyl]phenyl]acetamide
SMILESCC(=O)Nc1cccc(-c2cnc(N)c(-c3ccc(O)cc3)c2)c1
InChIInChI=1S/C19H17N3O2/c1-12(23)22-16-4-2-3-14(9-16)15-10-18(19(20)21-11-15)13-5-7-17(24)8-6-13/h2-11,24H,1H3,(H2,20,21)(H,22,23)
InChIKeyKBDXKGGQZIHXGB-UHFFFAOYSA-N
XLogP3.66
TPSA88.24 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.36
LogP ≤ 53.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[3-[6-amino-5-(4-hydroxyphenyl)-3-pyridinyl]phenyl]acetamide?
The IUPAC name of N-[3-[6-amino-5-(4-hydroxyphenyl)-3-pyridinyl]phenyl]acetamide (CID 126672795) is N-[3-[6-amino-5-(4-hydroxyphenyl)-3-pyridinyl]phenyl]acetamide.
What is the SMILES notation for N-[3-[6-amino-5-(4-hydroxyphenyl)-3-pyridinyl]phenyl]acetamide?
The canonical SMILES for N-[3-[6-amino-5-(4-hydroxyphenyl)-3-pyridinyl]phenyl]acetamide is CC(=O)Nc1cccc(-c2cnc(N)c(-c3ccc(O)cc3)c2)c1.
What is the InChIKey of N-[3-[6-amino-5-(4-hydroxyphenyl)-3-pyridinyl]phenyl]acetamide?
The InChIKey is KBDXKGGQZIHXGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O2/c1-12(23)22-16-4-2-3-14(9-16)15-10-18(19(20)21-11-15)13-5-7-17(24)8-6-13/h2-11,24H,1H3,(H2,20,21)(H,22,23).
What are the key properties of N-[3-[6-amino-5-(4-hydroxyphenyl)-3-pyridinyl]phenyl]acetamide?
N-[3-[6-amino-5-(4-hydroxyphenyl)-3-pyridinyl]phenyl]acetamide has a molecular weight of 319.36 g/mol, XLogP of 3.66, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[6-amino-5-(4-hydroxyphenyl)-3-pyridinyl]phenyl]acetamide is sourced from PubChem (CID 126672795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).