6-cyclopropyl-3-ethyl-4-hydrazinyl-N,N-dimethylhexan-3-amine

C13H29N3 — CID 105241793

IUPAC6-cyclopropyl-3-ethyl-4-hydrazinyl-N,N-dimethylhexan-3-amine
SMILESCCC(CC)(C(CCC1CC1)NN)N(C)C
InChIInChI=1S/C13H29N3/c1-5-13(6-2,16(3)4)12(15-14)10-9-11-7-8-11/h11-12,15H,5-10,14H2,1-4H3
InChIKeyXLPHWGLGZCOFLX-UHFFFAOYSA-N
MW227.40 g/mol
LogP2.13
Rot. Bonds8

About 6-cyclopropyl-3-ethyl-4-hydrazinyl-N,N-dimethylhexan-3-amine

6-cyclopropyl-3-ethyl-4-hydrazinyl-N,N-dimethylhexan-3-amine (PubChem CID 105241793) has the molecular formula C13H29N3 and a molecular weight of 227.40 g/mol. Its IUPAC name is 6-cyclopropyl-3-ethyl-4-hydrazinyl-N,N-dimethylhexan-3-amine.

Molecular Properties

Compound Name6-cyclopropyl-3-ethyl-4-hydrazinyl-N,N-dimethylhexan-3-amine
PubChem CID105241793
Molecular FormulaC13H29N3
Molecular Weight227.40 g/mol
Exact Mass227.24
IUPAC Name6-cyclopropyl-3-ethyl-4-hydrazinyl-N,N-dimethylhexan-3-amine
SMILESCCC(CC)(C(CCC1CC1)NN)N(C)C
InChIInChI=1S/C13H29N3/c1-5-13(6-2,16(3)4)12(15-14)10-9-11-7-8-11/h11-12,15H,5-10,14H2,1-4H3
InChIKeyXLPHWGLGZCOFLX-UHFFFAOYSA-N
XLogP2.13
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.40
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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 6-cyclopropyl-3-ethyl-4-hydrazinyl-N,N-dimethylhexan-3-amine?
The IUPAC name of 6-cyclopropyl-3-ethyl-4-hydrazinyl-N,N-dimethylhexan-3-amine (CID 105241793) is 6-cyclopropyl-3-ethyl-4-hydrazinyl-N,N-dimethylhexan-3-amine.
What is the SMILES notation for 6-cyclopropyl-3-ethyl-4-hydrazinyl-N,N-dimethylhexan-3-amine?
The canonical SMILES for 6-cyclopropyl-3-ethyl-4-hydrazinyl-N,N-dimethylhexan-3-amine is CCC(CC)(C(CCC1CC1)NN)N(C)C.
What is the InChIKey of 6-cyclopropyl-3-ethyl-4-hydrazinyl-N,N-dimethylhexan-3-amine?
The InChIKey is XLPHWGLGZCOFLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H29N3/c1-5-13(6-2,16(3)4)12(15-14)10-9-11-7-8-11/h11-12,15H,5-10,14H2,1-4H3.
What are the key properties of 6-cyclopropyl-3-ethyl-4-hydrazinyl-N,N-dimethylhexan-3-amine?
6-cyclopropyl-3-ethyl-4-hydrazinyl-N,N-dimethylhexan-3-amine has a molecular weight of 227.40 g/mol, XLogP of 2.13, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-3-ethyl-4-hydrazinyl-N,N-dimethylhexan-3-amine is sourced from PubChem (CID 105241793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).