(2-methyl-5-methylidene-2-pyrrolidin-1-ylheptan-3-yl)hydrazine

C13H27N3 — CID 105239709

IUPAC(2-methyl-5-methylidene-2-pyrrolidin-1-ylheptan-3-yl)hydrazine
SMILESC=C(CC)CC(NN)C(C)(C)N1CCCC1
InChIInChI=1S/C13H27N3/c1-5-11(2)10-12(15-14)13(3,4)16-8-6-7-9-16/h12,15H,2,5-10,14H2,1,3-4H3
InChIKeyFGWGBTCGUPPYGD-UHFFFAOYSA-N
MW225.38 g/mol
LogP2.05
Rot. Bonds6

About (2-methyl-5-methylidene-2-pyrrolidin-1-ylheptan-3-yl)hydrazine

(2-methyl-5-methylidene-2-pyrrolidin-1-ylheptan-3-yl)hydrazine (PubChem CID 105239709) has the molecular formula C13H27N3 and a molecular weight of 225.38 g/mol. Its IUPAC name is (2-methyl-5-methylidene-2-pyrrolidin-1-ylheptan-3-yl)hydrazine.

Molecular Properties

Compound Name(2-methyl-5-methylidene-2-pyrrolidin-1-ylheptan-3-yl)hydrazine
PubChem CID105239709
Molecular FormulaC13H27N3
Molecular Weight225.38 g/mol
Exact Mass225.22
IUPAC Name(2-methyl-5-methylidene-2-pyrrolidin-1-ylheptan-3-yl)hydrazine
SMILESC=C(CC)CC(NN)C(C)(C)N1CCCC1
InChIInChI=1S/C13H27N3/c1-5-11(2)10-12(15-14)13(3,4)16-8-6-7-9-16/h12,15H,2,5-10,14H2,1,3-4H3
InChIKeyFGWGBTCGUPPYGD-UHFFFAOYSA-N
XLogP2.05
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-methyl-5-methylidene-N-propyl-2-pyrrolidin-1-ylheptan-3-amine
CID 79044834
2-Methyl-5-methylidene-2-pyrrolidin-1-ylheptan-3-amine
CID 79056050
N,2-dimethyl-5-methylidene-2-pyrrolidin-1-ylheptan-3-amine
CID 79056230
N-ethyl-2-methyl-5-methylidene-2-pyrrolidin-1-ylheptan-3-amine
CID 79056906
3-Ethyl-6-methylidene-3-pyrrolidin-1-yloctan-4-amine
CID 79067996
N,3-dimethyl-6-methylidene-3-pyrrolidin-1-yloctan-4-amine
CID 79068728
3-Methyl-6-methylidene-3-pyrrolidin-1-yloctan-4-amine
CID 79069266
5-Ethyl-2-methyl-5-pyrrolidin-1-ylhept-1-en-4-amine
CID 79184979
2,5-Dimethyl-5-pyrrolidin-1-ylhept-1-en-4-amine
CID 79185734
2,5-Dimethyl-2-pyrrolidin-1-ylhex-5-en-3-amine
CID 79186190
3-hydrazinyl-N,N,2-trimethyloct-7-en-2-amine
CID 105238851
3-hydrazinyl-N,N,2,6-tetramethylhept-6-en-2-amine
CID 105238939

Frequently Asked Questions

What is the IUPAC name of (2-methyl-5-methylidene-2-pyrrolidin-1-ylheptan-3-yl)hydrazine?
The IUPAC name of (2-methyl-5-methylidene-2-pyrrolidin-1-ylheptan-3-yl)hydrazine (CID 105239709) is (2-methyl-5-methylidene-2-pyrrolidin-1-ylheptan-3-yl)hydrazine.
What is the SMILES notation for (2-methyl-5-methylidene-2-pyrrolidin-1-ylheptan-3-yl)hydrazine?
The canonical SMILES for (2-methyl-5-methylidene-2-pyrrolidin-1-ylheptan-3-yl)hydrazine is C=C(CC)CC(NN)C(C)(C)N1CCCC1.
What is the InChIKey of (2-methyl-5-methylidene-2-pyrrolidin-1-ylheptan-3-yl)hydrazine?
The InChIKey is FGWGBTCGUPPYGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3/c1-5-11(2)10-12(15-14)13(3,4)16-8-6-7-9-16/h12,15H,2,5-10,14H2,1,3-4H3.
What are the key properties of (2-methyl-5-methylidene-2-pyrrolidin-1-ylheptan-3-yl)hydrazine?
(2-methyl-5-methylidene-2-pyrrolidin-1-ylheptan-3-yl)hydrazine has a molecular weight of 225.38 g/mol, XLogP of 2.05, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methyl-5-methylidene-2-pyrrolidin-1-ylheptan-3-yl)hydrazine is sourced from PubChem (CID 105239709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).