1-methyl-2-[4-(pyrrolidin-1-ylmethyl)pent-4-enyl]hydrazine

C11H23N3 — CID 138721194

IUPAC1-methyl-2-[4-(pyrrolidin-1-ylmethyl)pent-4-enyl]hydrazine
SMILESC=C(CCCNNC)CN1CCCC1
InChIInChI=1S/C11H23N3/c1-11(6-5-7-13-12-2)10-14-8-3-4-9-14/h12-13H,1,3-10H2,2H3
InChIKeyKWOKVVJQTZKVAG-UHFFFAOYSA-N
MW197.33 g/mol
LogP1.14
Rot. Bonds7

About 1-methyl-2-[4-(pyrrolidin-1-ylmethyl)pent-4-enyl]hydrazine

1-methyl-2-[4-(pyrrolidin-1-ylmethyl)pent-4-enyl]hydrazine (PubChem CID 138721194) has the molecular formula C11H23N3 and a molecular weight of 197.33 g/mol. Its IUPAC name is 1-methyl-2-[4-(pyrrolidin-1-ylmethyl)pent-4-enyl]hydrazine.

Molecular Properties

Compound Name1-methyl-2-[4-(pyrrolidin-1-ylmethyl)pent-4-enyl]hydrazine
PubChem CID138721194
Molecular FormulaC11H23N3
Molecular Weight197.33 g/mol
Exact Mass197.19
IUPAC Name1-methyl-2-[4-(pyrrolidin-1-ylmethyl)pent-4-enyl]hydrazine
SMILESC=C(CCCNNC)CN1CCCC1
InChIInChI=1S/C11H23N3/c1-11(6-5-7-13-12-2)10-14-8-3-4-9-14/h12-13H,1,3-10H2,2H3
InChIKeyKWOKVVJQTZKVAG-UHFFFAOYSA-N
XLogP1.14
TPSA27.30 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.33
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', '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 1-methyl-2-[4-(pyrrolidin-1-ylmethyl)pent-4-enyl]hydrazine?
The IUPAC name of 1-methyl-2-[4-(pyrrolidin-1-ylmethyl)pent-4-enyl]hydrazine (CID 138721194) is 1-methyl-2-[4-(pyrrolidin-1-ylmethyl)pent-4-enyl]hydrazine.
What is the SMILES notation for 1-methyl-2-[4-(pyrrolidin-1-ylmethyl)pent-4-enyl]hydrazine?
The canonical SMILES for 1-methyl-2-[4-(pyrrolidin-1-ylmethyl)pent-4-enyl]hydrazine is C=C(CCCNNC)CN1CCCC1.
What is the InChIKey of 1-methyl-2-[4-(pyrrolidin-1-ylmethyl)pent-4-enyl]hydrazine?
The InChIKey is KWOKVVJQTZKVAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3/c1-11(6-5-7-13-12-2)10-14-8-3-4-9-14/h12-13H,1,3-10H2,2H3.
What are the key properties of 1-methyl-2-[4-(pyrrolidin-1-ylmethyl)pent-4-enyl]hydrazine?
1-methyl-2-[4-(pyrrolidin-1-ylmethyl)pent-4-enyl]hydrazine has a molecular weight of 197.33 g/mol, XLogP of 1.14, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-[4-(pyrrolidin-1-ylmethyl)pent-4-enyl]hydrazine is sourced from PubChem (CID 138721194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).