2-[2,3-dihydrofuran-5-yl(hydrazinyl)methyl]aniline

C11H15N3O — CID 102654162

IUPAC2-[2,3-dihydrofuran-5-yl(hydrazinyl)methyl]aniline
SMILESNNC(C1=CCCO1)c1ccccc1N
InChIInChI=1S/C11H15N3O/c12-9-5-2-1-4-8(9)11(14-13)10-6-3-7-15-10/h1-2,4-6,11,14H,3,7,12-13H2
InChIKeyZAYPEOZBHFBNMK-UHFFFAOYSA-N
MW205.26 g/mol
LogP1.08
Rot. Bonds3

About 2-[2,3-dihydrofuran-5-yl(hydrazinyl)methyl]aniline

2-[2,3-dihydrofuran-5-yl(hydrazinyl)methyl]aniline (PubChem CID 102654162) has the molecular formula C11H15N3O and a molecular weight of 205.26 g/mol. Its IUPAC name is 2-[2,3-dihydrofuran-5-yl(hydrazinyl)methyl]aniline.

Molecular Properties

Compound Name2-[2,3-dihydrofuran-5-yl(hydrazinyl)methyl]aniline
PubChem CID102654162
Molecular FormulaC11H15N3O
Molecular Weight205.26 g/mol
Exact Mass205.12
IUPAC Name2-[2,3-dihydrofuran-5-yl(hydrazinyl)methyl]aniline
SMILESNNC(C1=CCCO1)c1ccccc1N
InChIInChI=1S/C11H15N3O/c12-9-5-2-1-4-8(9)11(14-13)10-6-3-7-15-10/h1-2,4-6,11,14H,3,7,12-13H2
InChIKeyZAYPEOZBHFBNMK-UHFFFAOYSA-N
XLogP1.08
TPSA73.30 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 51.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

[(2-bromo-3-methylphenyl)-(2,3-dihydrofuran-5-yl)methyl]hydrazine
CID 107986221
[2,3-dihydrofuran-5-yl-(2,3-dimethoxyphenyl)methyl]hydrazine
CID 102654403
[2,3-dihydrofuran-5-yl(furan-2-yl)methyl]hydrazine
CID 102654121
[2,3-dihydrofuran-5-yl(thiophen-2-yl)methyl]hydrazine
CID 102654047
[2,3-dihydrofuran-5-yl(pyridin-4-yl)methyl]hydrazine
CID 102654057
[1-benzothiophen-3-yl(3,4-dihydro-2H-pyran-6-yl)methyl]hydrazine
CID 102650251
[2,3-dihydrofuran-5-yl-(3,5-dimethylphenyl)methyl]hydrazine
CID 102654461
[(5-bromo-2-pyridinyl)-(2,3-dihydrofuran-5-yl)methyl]hydrazine
CID 102654319
N-[(2-tert-butylphenyl)-(2,3-dihydrofuran-5-yl)methyl]ethanamine
CID 102653731
[(3-chloro-4-fluorophenyl)-(2,3-dihydrofuran-5-yl)methyl]hydrazine
CID 102654140
1-(2,3-dihydrofuran-5-yl)-1-(2-ethoxyphenyl)-N-methylmethanamine
CID 102652083
[(3-bromo-4-chlorophenyl)-(2,3-dihydrofuran-5-yl)methyl]hydrazine
CID 102654296

Frequently Asked Questions

What is the IUPAC name of 2-[2,3-dihydrofuran-5-yl(hydrazinyl)methyl]aniline?
The IUPAC name of 2-[2,3-dihydrofuran-5-yl(hydrazinyl)methyl]aniline (CID 102654162) is 2-[2,3-dihydrofuran-5-yl(hydrazinyl)methyl]aniline.
What is the SMILES notation for 2-[2,3-dihydrofuran-5-yl(hydrazinyl)methyl]aniline?
The canonical SMILES for 2-[2,3-dihydrofuran-5-yl(hydrazinyl)methyl]aniline is NNC(C1=CCCO1)c1ccccc1N.
What is the InChIKey of 2-[2,3-dihydrofuran-5-yl(hydrazinyl)methyl]aniline?
The InChIKey is ZAYPEOZBHFBNMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O/c12-9-5-2-1-4-8(9)11(14-13)10-6-3-7-15-10/h1-2,4-6,11,14H,3,7,12-13H2.
What are the key properties of 2-[2,3-dihydrofuran-5-yl(hydrazinyl)methyl]aniline?
2-[2,3-dihydrofuran-5-yl(hydrazinyl)methyl]aniline has a molecular weight of 205.26 g/mol, XLogP of 1.08, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2,3-dihydrofuran-5-yl(hydrazinyl)methyl]aniline is sourced from PubChem (CID 102654162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).