4-phenylbutan-2-ylhydrazine

C10H16N2 — CID 28622

IUPAC4-phenylbutan-2-ylhydrazine
SMILESCC(CCc1ccccc1)NN
InChIInChI=1S/C10H16N2/c1-9(12-11)7-8-10-5-3-2-4-6-10/h2-6,9,12H,7-8,11H2,1H3
InChIKeyKWOFPMARHNBNHU-UHFFFAOYSA-N
MW164.25 g/mol
LogP1.47
Rot. Bonds4

About 4-phenylbutan-2-ylhydrazine

4-phenylbutan-2-ylhydrazine (PubChem CID 28622) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is 4-phenylbutan-2-ylhydrazine.

Molecular Properties

Compound Name4-phenylbutan-2-ylhydrazine
PubChem CID28622
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC Name4-phenylbutan-2-ylhydrazine
SMILESCC(CCc1ccccc1)NN
InChIInChI=1S/C10H16N2/c1-9(12-11)7-8-10-5-3-2-4-6-10/h2-6,9,12H,7-8,11H2,1H3
InChIKeyKWOFPMARHNBNHU-UHFFFAOYSA-N
XLogP1.47
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-(2-methylphenyl)butan-2-ylhydrazine
CID 105282545
(4-phenylbutan-2-ylamino) thiohypofluorite
CID 138664614
(2R)-2-amino-N-(4-phenylbutan-2-yl)propanamide
CID 14620809
(2S)-4-phenylbutan-2-amine
CID 6994564
(2S)-4-phenyl-N-[(1R)-1-phenylethyl]butan-2-amine
CID 12814796
N-[(2S)-4-phenylbutan-2-yl]acetamide
CID 6933208
6-hydrazinyl-N-(4-phenylbutan-2-yl)pyridin-2-amine
CID 80903512
N,N'-bis[(2S)-4-phenylbutan-2-yl]butanediamide
CID 7409928
4-phenyl-N-phenylmethoxybutan-2-amine
CID 82709894
2-amino-2-phenyl-N-(4-phenylbutan-2-yl)acetamide
CID 61254237
4-amino-2-methyl-N-(4-phenylbutan-2-yl)butanamide
CID 80543602
(4-methoxy-5-methyl-1-phenylhexan-3-yl)hydrazine
CID 105271973

Frequently Asked Questions

What is the IUPAC name of 4-phenylbutan-2-ylhydrazine?
The IUPAC name of 4-phenylbutan-2-ylhydrazine (CID 28622) is 4-phenylbutan-2-ylhydrazine.
What is the SMILES notation for 4-phenylbutan-2-ylhydrazine?
The canonical SMILES for 4-phenylbutan-2-ylhydrazine is CC(CCc1ccccc1)NN.
What is the InChIKey of 4-phenylbutan-2-ylhydrazine?
The InChIKey is KWOFPMARHNBNHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2/c1-9(12-11)7-8-10-5-3-2-4-6-10/h2-6,9,12H,7-8,11H2,1H3.
What are the key properties of 4-phenylbutan-2-ylhydrazine?
4-phenylbutan-2-ylhydrazine has a molecular weight of 164.25 g/mol, XLogP of 1.47, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenylbutan-2-ylhydrazine is sourced from PubChem (CID 28622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).