3-hydrazinyl-N,N-dimethyl-3-(2-propan-2-yloxyphenyl)propan-1-amine

C14H25N3O — CID 105259287

IUPAC3-hydrazinyl-N,N-dimethyl-3-(2-propan-2-yloxyphenyl)propan-1-amine
SMILESCC(C)Oc1ccccc1C(CCN(C)C)NN
InChIInChI=1S/C14H25N3O/c1-11(2)18-14-8-6-5-7-12(14)13(16-15)9-10-17(3)4/h5-8,11,13,16H,9-10,15H2,1-4H3
InChIKeyIQNKVYVEMLCSDC-UHFFFAOYSA-N
MW251.37 g/mol
LogP1.93
Rot. Bonds7

About 3-hydrazinyl-N,N-dimethyl-3-(2-propan-2-yloxyphenyl)propan-1-amine

3-hydrazinyl-N,N-dimethyl-3-(2-propan-2-yloxyphenyl)propan-1-amine (PubChem CID 105259287) has the molecular formula C14H25N3O and a molecular weight of 251.37 g/mol. Its IUPAC name is 3-hydrazinyl-N,N-dimethyl-3-(2-propan-2-yloxyphenyl)propan-1-amine.

Molecular Properties

Compound Name3-hydrazinyl-N,N-dimethyl-3-(2-propan-2-yloxyphenyl)propan-1-amine
PubChem CID105259287
Molecular FormulaC14H25N3O
Molecular Weight251.37 g/mol
Exact Mass251.20
IUPAC Name3-hydrazinyl-N,N-dimethyl-3-(2-propan-2-yloxyphenyl)propan-1-amine
SMILESCC(C)Oc1ccccc1C(CCN(C)C)NN
InChIInChI=1S/C14H25N3O/c1-11(2)18-14-8-6-5-7-12(14)13(16-15)9-10-17(3)4/h5-8,11,13,16H,9-10,15H2,1-4H3
InChIKeyIQNKVYVEMLCSDC-UHFFFAOYSA-N
XLogP1.93
TPSA50.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 51.93
H-Bond Donors ≤ 52
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 3-hydrazinyl-N,N-dimethyl-3-(2-propan-2-yloxyphenyl)propan-1-amine?
The IUPAC name of 3-hydrazinyl-N,N-dimethyl-3-(2-propan-2-yloxyphenyl)propan-1-amine (CID 105259287) is 3-hydrazinyl-N,N-dimethyl-3-(2-propan-2-yloxyphenyl)propan-1-amine.
What is the SMILES notation for 3-hydrazinyl-N,N-dimethyl-3-(2-propan-2-yloxyphenyl)propan-1-amine?
The canonical SMILES for 3-hydrazinyl-N,N-dimethyl-3-(2-propan-2-yloxyphenyl)propan-1-amine is CC(C)Oc1ccccc1C(CCN(C)C)NN.
What is the InChIKey of 3-hydrazinyl-N,N-dimethyl-3-(2-propan-2-yloxyphenyl)propan-1-amine?
The InChIKey is IQNKVYVEMLCSDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O/c1-11(2)18-14-8-6-5-7-12(14)13(16-15)9-10-17(3)4/h5-8,11,13,16H,9-10,15H2,1-4H3.
What are the key properties of 3-hydrazinyl-N,N-dimethyl-3-(2-propan-2-yloxyphenyl)propan-1-amine?
3-hydrazinyl-N,N-dimethyl-3-(2-propan-2-yloxyphenyl)propan-1-amine has a molecular weight of 251.37 g/mol, XLogP of 1.93, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydrazinyl-N,N-dimethyl-3-(2-propan-2-yloxyphenyl)propan-1-amine is sourced from PubChem (CID 105259287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).