(Z)-N-ethyl-N-methyl-3-(2-methylhydrazinyl)pent-3-en-1-amine

C9H21N3 — CID 118617252

IUPAC(Z)-N-ethyl-N-methyl-3-(2-methylhydrazinyl)pent-3-en-1-amine
SMILESC/C=C(/CCN(C)CC)NNC
InChIInChI=1S/C9H21N3/c1-5-9(11-10-3)7-8-12(4)6-2/h5,10-11H,6-8H2,1-4H3/b9-5-
InChIKeyNQNYHSJRKOAPSB-UITAMQMPSA-N
MW171.29 g/mol
LogP0.96
Rot. Bonds6

About (Z)-N-ethyl-N-methyl-3-(2-methylhydrazinyl)pent-3-en-1-amine

(Z)-N-ethyl-N-methyl-3-(2-methylhydrazinyl)pent-3-en-1-amine (PubChem CID 118617252) has the molecular formula C9H21N3 and a molecular weight of 171.29 g/mol. Its IUPAC name is (Z)-N-ethyl-N-methyl-3-(2-methylhydrazinyl)pent-3-en-1-amine.

Molecular Properties

Compound Name(Z)-N-ethyl-N-methyl-3-(2-methylhydrazinyl)pent-3-en-1-amine
PubChem CID118617252
Molecular FormulaC9H21N3
Molecular Weight171.29 g/mol
Exact Mass171.17
IUPAC Name(Z)-N-ethyl-N-methyl-3-(2-methylhydrazinyl)pent-3-en-1-amine
SMILESC/C=C(/CCN(C)CC)NNC
InChIInChI=1S/C9H21N3/c1-5-9(11-10-3)7-8-12(4)6-2/h5,10-11H,6-8H2,1-4H3/b9-5-
InChIKeyNQNYHSJRKOAPSB-UITAMQMPSA-N
XLogP0.96
TPSA27.30 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.29
LogP ≤ 50.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z)-N-ethyl-N-methyl-3-(2-methylhydrazinyl)pent-3-en-1-amine?
The IUPAC name of (Z)-N-ethyl-N-methyl-3-(2-methylhydrazinyl)pent-3-en-1-amine (CID 118617252) is (Z)-N-ethyl-N-methyl-3-(2-methylhydrazinyl)pent-3-en-1-amine.
What is the SMILES notation for (Z)-N-ethyl-N-methyl-3-(2-methylhydrazinyl)pent-3-en-1-amine?
The canonical SMILES for (Z)-N-ethyl-N-methyl-3-(2-methylhydrazinyl)pent-3-en-1-amine is C/C=C(/CCN(C)CC)NNC.
What is the InChIKey of (Z)-N-ethyl-N-methyl-3-(2-methylhydrazinyl)pent-3-en-1-amine?
The InChIKey is NQNYHSJRKOAPSB-UITAMQMPSA-N. The full InChI is InChI=1S/C9H21N3/c1-5-9(11-10-3)7-8-12(4)6-2/h5,10-11H,6-8H2,1-4H3/b9-5-.
What are the key properties of (Z)-N-ethyl-N-methyl-3-(2-methylhydrazinyl)pent-3-en-1-amine?
(Z)-N-ethyl-N-methyl-3-(2-methylhydrazinyl)pent-3-en-1-amine has a molecular weight of 171.29 g/mol, XLogP of 0.96, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-ethyl-N-methyl-3-(2-methylhydrazinyl)pent-3-en-1-amine is sourced from PubChem (CID 118617252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).