N-[4-[(5,6-diamino-2-pyridinyl)oxy]phenyl]acetamide

C13H14N4O2 — CID 110178603

IUPACN-[4-[(5,6-diamino-2-pyridinyl)oxy]phenyl]acetamide
SMILESCC(=O)Nc1ccc(Oc2ccc(N)c(N)n2)cc1
InChIInChI=1S/C13H14N4O2/c1-8(18)16-9-2-4-10(5-3-9)19-12-7-6-11(14)13(15)17-12/h2-7H,14H2,1H3,(H2,15,17)(H,16,18)
InChIKeyQAUAEXVHIOHJTF-UHFFFAOYSA-N
MW258.28 g/mol
LogP2.00
Rot. Bonds3

About N-[4-[(5,6-diamino-2-pyridinyl)oxy]phenyl]acetamide

N-[4-[(5,6-diamino-2-pyridinyl)oxy]phenyl]acetamide (PubChem CID 110178603) has the molecular formula C13H14N4O2 and a molecular weight of 258.28 g/mol. Its IUPAC name is N-[4-[(5,6-diamino-2-pyridinyl)oxy]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[(5,6-diamino-2-pyridinyl)oxy]phenyl]acetamide
PubChem CID110178603
Molecular FormulaC13H14N4O2
Molecular Weight258.28 g/mol
Exact Mass258.11
IUPAC NameN-[4-[(5,6-diamino-2-pyridinyl)oxy]phenyl]acetamide
SMILESCC(=O)Nc1ccc(Oc2ccc(N)c(N)n2)cc1
InChIInChI=1S/C13H14N4O2/c1-8(18)16-9-2-4-10(5-3-9)19-12-7-6-11(14)13(15)17-12/h2-7H,14H2,1H3,(H2,15,17)(H,16,18)
InChIKeyQAUAEXVHIOHJTF-UHFFFAOYSA-N
XLogP2.00
TPSA103.26 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.28
LogP ≤ 52.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-(2-aminophenoxy)phenyl]acetamide
CID 101461419
N-[4-[(5,6-diamino-2-pyridinyl)sulfanyl]phenyl]acetamide
CID 79825462
6-(4-iodophenoxy)pyridine-2,3-diamine
CID 79826483
N-(4-quinoxalin-2-yloxyphenyl)acetamide
CID 1473207
N-(4-pyridin-4-yloxyphenyl)acetamide
CID 49363593
6-(4-acetamidophenoxy)-N-phenylpyridazine-3-carboxamide
CID 133313253
N-[4-(4-nitrophenoxy)phenyl]acetamide
CID 139084350
4-[[6-(4-acetamidophenoxy)-3-pyridinyl]amino]-4-oxobutanoic acid
CID 39194101
N-(4-acetamidophenyl)-6-(4-bromophenoxy)pyridine-3-carboxamide
CID 46488305
N-[4-[3-ethyl-5-(4-methoxyphenoxy)imidazo[4,5-b]pyridin-2-yl]phenyl]acetamide
CID 102500827
ethyl 3-[[6-(4-acetamidophenoxy)-3-nitro-2-pyridinyl]amino]propanoate
CID 58905690
1-[4-(2-aminopyrimidin-4-yl)oxyphenyl]-3-phenylurea
CID 22936793

Frequently Asked Questions

What is the IUPAC name of N-[4-[(5,6-diamino-2-pyridinyl)oxy]phenyl]acetamide?
The IUPAC name of N-[4-[(5,6-diamino-2-pyridinyl)oxy]phenyl]acetamide (CID 110178603) is N-[4-[(5,6-diamino-2-pyridinyl)oxy]phenyl]acetamide.
What is the SMILES notation for N-[4-[(5,6-diamino-2-pyridinyl)oxy]phenyl]acetamide?
The canonical SMILES for N-[4-[(5,6-diamino-2-pyridinyl)oxy]phenyl]acetamide is CC(=O)Nc1ccc(Oc2ccc(N)c(N)n2)cc1.
What is the InChIKey of N-[4-[(5,6-diamino-2-pyridinyl)oxy]phenyl]acetamide?
The InChIKey is QAUAEXVHIOHJTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N4O2/c1-8(18)16-9-2-4-10(5-3-9)19-12-7-6-11(14)13(15)17-12/h2-7H,14H2,1H3,(H2,15,17)(H,16,18).
What are the key properties of N-[4-[(5,6-diamino-2-pyridinyl)oxy]phenyl]acetamide?
N-[4-[(5,6-diamino-2-pyridinyl)oxy]phenyl]acetamide has a molecular weight of 258.28 g/mol, XLogP of 2.00, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(5,6-diamino-2-pyridinyl)oxy]phenyl]acetamide is sourced from PubChem (CID 110178603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).