2-aminopropan-1-ol;(3-chlorophenyl)hydrazine;ethane

C11H22ClN3O — CID 143576904

IUPAC2-aminopropan-1-ol;(3-chlorophenyl)hydrazine;ethane
SMILESCC.CC(N)CO.NNc1cccc(Cl)c1
InChIInChI=1S/C6H7ClN2.C3H9NO.C2H6/c7-5-2-1-3-6(4-5)9-8;1-3(4)2-5;1-2/h1-4,9H,8H2;3,5H,2,4H2,1H3;1-2H3
InChIKeyYTXNFVCLNNLXRD-UHFFFAOYSA-N
MW247.77 g/mol
LogP1.98
Rot. Bonds2

About 2-aminopropan-1-ol;(3-chlorophenyl)hydrazine;ethane

2-aminopropan-1-ol;(3-chlorophenyl)hydrazine;ethane (PubChem CID 143576904) has the molecular formula C11H22ClN3O and a molecular weight of 247.77 g/mol. Its IUPAC name is 2-aminopropan-1-ol;(3-chlorophenyl)hydrazine;ethane.

Molecular Properties

Compound Name2-aminopropan-1-ol;(3-chlorophenyl)hydrazine;ethane
PubChem CID143576904
Molecular FormulaC11H22ClN3O
Molecular Weight247.77 g/mol
Exact Mass247.15
IUPAC Name2-aminopropan-1-ol;(3-chlorophenyl)hydrazine;ethane
SMILESCC.CC(N)CO.NNc1cccc(Cl)c1
InChIInChI=1S/C6H7ClN2.C3H9NO.C2H6/c7-5-2-1-3-6(4-5)9-8;1-3(4)2-5;1-2/h1-4,9H,8H2;3,5H,2,4H2,1H3;1-2H3
InChIKeyYTXNFVCLNNLXRD-UHFFFAOYSA-N
XLogP1.98
TPSA84.30 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.77
LogP ≤ 51.98
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-aminopropan-1-ol;(3-chlorophenyl)hydrazine;ethane?
The IUPAC name of 2-aminopropan-1-ol;(3-chlorophenyl)hydrazine;ethane (CID 143576904) is 2-aminopropan-1-ol;(3-chlorophenyl)hydrazine;ethane.
What is the SMILES notation for 2-aminopropan-1-ol;(3-chlorophenyl)hydrazine;ethane?
The canonical SMILES for 2-aminopropan-1-ol;(3-chlorophenyl)hydrazine;ethane is CC.CC(N)CO.NNc1cccc(Cl)c1.
What is the InChIKey of 2-aminopropan-1-ol;(3-chlorophenyl)hydrazine;ethane?
The InChIKey is YTXNFVCLNNLXRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7ClN2.C3H9NO.C2H6/c7-5-2-1-3-6(4-5)9-8;1-3(4)2-5;1-2/h1-4,9H,8H2;3,5H,2,4H2,1H3;1-2H3.
What are the key properties of 2-aminopropan-1-ol;(3-chlorophenyl)hydrazine;ethane?
2-aminopropan-1-ol;(3-chlorophenyl)hydrazine;ethane has a molecular weight of 247.77 g/mol, XLogP of 1.98, 2 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminopropan-1-ol;(3-chlorophenyl)hydrazine;ethane is sourced from PubChem (CID 143576904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).