(Z)-N-methyl-2-(2-methylhydrazinyl)but-1-en-3-yn-1-amine

C6H11N3 — CID 134232956

IUPAC(Z)-N-methyl-2-(2-methylhydrazinyl)but-1-en-3-yn-1-amine
SMILESC#C/C(=C/NC)NNC
InChIInChI=1S/C6H11N3/c1-4-6(5-7-2)9-8-3/h1,5,7-9H,2-3H3/b6-5-
InChIKeyKLIAOUINOQPFFY-WAYWQWQTSA-N
MW125.17 g/mol
LogP-0.60
Rot. Bonds3

About (Z)-N-methyl-2-(2-methylhydrazinyl)but-1-en-3-yn-1-amine

(Z)-N-methyl-2-(2-methylhydrazinyl)but-1-en-3-yn-1-amine (PubChem CID 134232956) has the molecular formula C6H11N3 and a molecular weight of 125.17 g/mol. Its IUPAC name is (Z)-N-methyl-2-(2-methylhydrazinyl)but-1-en-3-yn-1-amine.

Molecular Properties

Compound Name(Z)-N-methyl-2-(2-methylhydrazinyl)but-1-en-3-yn-1-amine
PubChem CID134232956
Molecular FormulaC6H11N3
Molecular Weight125.17 g/mol
Exact Mass125.10
IUPAC Name(Z)-N-methyl-2-(2-methylhydrazinyl)but-1-en-3-yn-1-amine
SMILESC#C/C(=C/NC)NNC
InChIInChI=1S/C6H11N3/c1-4-6(5-7-2)9-8-3/h1,5,7-9H,2-3H3/b6-5-
InChIKeyKLIAOUINOQPFFY-WAYWQWQTSA-N
XLogP-0.60
TPSA36.09 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.17
LogP ≤ 5-0.60
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(E)-2-chloro-N-methyl-2-(2-methylhydrazinyl)ethenamine
CID 166827636
(E)-2-tert-butyl-N-methylpent-1-en-4-yn-1-amine
CID 130178755
(E)-3-fluoro-N-methyl-2-(2-methylhydrazinyl)but-1-en-1-amine
CID 155411637
(Z)-2-ethynyl-N-methylbut-2-en-1-amine
CID 177172264
(3Z,5E,7E)-N-methyl-6-prop-1-en-2-ylnona-3,5,7-trien-1-yn-3-amine
CID 166803174
(1Z)-2-fluoro-N-methylbuta-1,3-dien-1-amine
CID 143572818
N-(113C)methyl(113C)methan(15N)amine
CID 71309073
N-methylmethanamine
CID 674
(1Z,3E)-1-N-methyl-3-prop-2-ynylhexa-1,3-diene-1,2-diamine
CID 130372367
N'-methylprop-2-enehydrazide
CID 19086393
N-[(3E,6Z)-octa-3,6-dien-1-yn-3-yl]formamide
CID 142950097
(3Z,5E)-3,5-difluoro-N-methylhepta-3,5-dien-1-yn-4-amine
CID 143518126

Frequently Asked Questions

What is the IUPAC name of (Z)-N-methyl-2-(2-methylhydrazinyl)but-1-en-3-yn-1-amine?
The IUPAC name of (Z)-N-methyl-2-(2-methylhydrazinyl)but-1-en-3-yn-1-amine (CID 134232956) is (Z)-N-methyl-2-(2-methylhydrazinyl)but-1-en-3-yn-1-amine.
What is the SMILES notation for (Z)-N-methyl-2-(2-methylhydrazinyl)but-1-en-3-yn-1-amine?
The canonical SMILES for (Z)-N-methyl-2-(2-methylhydrazinyl)but-1-en-3-yn-1-amine is C#C/C(=C/NC)NNC.
What is the InChIKey of (Z)-N-methyl-2-(2-methylhydrazinyl)but-1-en-3-yn-1-amine?
The InChIKey is KLIAOUINOQPFFY-WAYWQWQTSA-N. The full InChI is InChI=1S/C6H11N3/c1-4-6(5-7-2)9-8-3/h1,5,7-9H,2-3H3/b6-5-.
What are the key properties of (Z)-N-methyl-2-(2-methylhydrazinyl)but-1-en-3-yn-1-amine?
(Z)-N-methyl-2-(2-methylhydrazinyl)but-1-en-3-yn-1-amine has a molecular weight of 125.17 g/mol, XLogP of -0.60, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-methyl-2-(2-methylhydrazinyl)but-1-en-3-yn-1-amine is sourced from PubChem (CID 134232956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).