N'-[2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetyl]pyridine-3-carbohydrazide

C20H19N3O4 — CID 35015838

IUPACN'-[2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetyl]pyridine-3-carbohydrazide
SMILESO=C(COc1ccc2oc3c(c2c1)CCCC3)NNC(=O)c1cccnc1
InChIInChI=1S/C20H19N3O4/c24-19(22-23-20(25)13-4-3-9-21-11-13)12-26-14-7-8-18-16(10-14)15-5-1-2-6-17(15)27-18/h3-4,7-11H,1-2,5-6,12H2,(H,22,24)(H,23,25)
InChIKeySMNKHHAKKYPNJL-UHFFFAOYSA-N
MW365.39 g/mol
LogP2.55
Rot. Bonds4

About N'-[2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetyl]pyridine-3-carbohydrazide

N'-[2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetyl]pyridine-3-carbohydrazide (PubChem CID 35015838) has the molecular formula C20H19N3O4 and a molecular weight of 365.39 g/mol. Its IUPAC name is N'-[2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetyl]pyridine-3-carbohydrazide.

Molecular Properties

Compound NameN'-[2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetyl]pyridine-3-carbohydrazide
PubChem CID35015838
Molecular FormulaC20H19N3O4
Molecular Weight365.39 g/mol
Exact Mass365.14
IUPAC NameN'-[2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetyl]pyridine-3-carbohydrazide
SMILESO=C(COc1ccc2oc3c(c2c1)CCCC3)NNC(=O)c1cccnc1
InChIInChI=1S/C20H19N3O4/c24-19(22-23-20(25)13-4-3-9-21-11-13)12-26-14-7-8-18-16(10-14)15-5-1-2-6-17(15)27-18/h3-4,7-11H,1-2,5-6,12H2,(H,22,24)(H,23,25)
InChIKeySMNKHHAKKYPNJL-UHFFFAOYSA-N
XLogP2.55
TPSA93.46 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.39
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

pyridin-3-ylmethyl 2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetate
CID 71944710
N-(pyridin-2-ylmethyl)-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide
CID 8880601
N-ethoxy-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide
CID 46536426
N'-[2-(3-methoxyphenoxy)acetyl]pyridine-3-carbohydrazide
CID 17386186
N'-[2-(4-methylphenoxy)acetyl]pyridine-3-carbohydrazide
CID 839627
N-(4-methoxyphenyl)-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide
CID 3772122
N-(4-acetylphenyl)-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide
CID 8712821
N-[2-[[2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetyl]amino]phenyl]pyrrolidine-1-carboxamide
CID 55737258
2-[[2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetyl]amino]-N-(2,2,2-trifluoroethyl)benzamide
CID 16566350
N-[2-(methylamino)propyl]-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide;hydrochloride
CID 120827134
N-[(3S)-2-oxopiperidin-3-yl]-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide
CID 95048353
N-(4-methylsulfonylphenyl)-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide
CID 8840330

Frequently Asked Questions

What is the IUPAC name of N'-[2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetyl]pyridine-3-carbohydrazide?
The IUPAC name of N'-[2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetyl]pyridine-3-carbohydrazide (CID 35015838) is N'-[2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetyl]pyridine-3-carbohydrazide.
What is the SMILES notation for N'-[2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetyl]pyridine-3-carbohydrazide?
The canonical SMILES for N'-[2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetyl]pyridine-3-carbohydrazide is O=C(COc1ccc2oc3c(c2c1)CCCC3)NNC(=O)c1cccnc1.
What is the InChIKey of N'-[2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetyl]pyridine-3-carbohydrazide?
The InChIKey is SMNKHHAKKYPNJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O4/c24-19(22-23-20(25)13-4-3-9-21-11-13)12-26-14-7-8-18-16(10-14)15-5-1-2-6-17(15)27-18/h3-4,7-11H,1-2,5-6,12H2,(H,22,24)(H,23,25).
What are the key properties of N'-[2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetyl]pyridine-3-carbohydrazide?
N'-[2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetyl]pyridine-3-carbohydrazide has a molecular weight of 365.39 g/mol, XLogP of 2.55, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetyl]pyridine-3-carbohydrazide is sourced from PubChem (CID 35015838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).