butane;N,3-dimethyl-N-(methylideneamino)but-2-en-2-amine

C11H24N2 — CID 143436388

IUPACbutane;N,3-dimethyl-N-(methylideneamino)but-2-en-2-amine
SMILESC=NN(C)C(C)=C(C)C.CCCC
InChIInChI=1S/C7H14N2.C4H10/c1-6(2)7(3)9(5)8-4;1-3-4-2/h4H2,1-3,5H3;3-4H2,1-2H3
InChIKeyNKMGAHWTLRYTPO-UHFFFAOYSA-N
MW184.33 g/mol
LogP3.65
Rot. Bonds3

About butane;N,3-dimethyl-N-(methylideneamino)but-2-en-2-amine

butane;N,3-dimethyl-N-(methylideneamino)but-2-en-2-amine (PubChem CID 143436388) has the molecular formula C11H24N2 and a molecular weight of 184.33 g/mol. Its IUPAC name is butane;N,3-dimethyl-N-(methylideneamino)but-2-en-2-amine.

Molecular Properties

Compound Namebutane;N,3-dimethyl-N-(methylideneamino)but-2-en-2-amine
PubChem CID143436388
Molecular FormulaC11H24N2
Molecular Weight184.33 g/mol
Exact Mass184.19
IUPAC Namebutane;N,3-dimethyl-N-(methylideneamino)but-2-en-2-amine
SMILESC=NN(C)C(C)=C(C)C.CCCC
InChIInChI=1S/C7H14N2.C4H10/c1-6(2)7(3)9(5)8-4;1-3-4-2/h4H2,1-3,5H3;3-4H2,1-2H3
InChIKeyNKMGAHWTLRYTPO-UHFFFAOYSA-N
XLogP3.65
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.33
LogP ≤ 53.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1,1,3-trimethyl-3-(methylideneamino)urea
CID 91400900
butane;ethane;2-methylprop-1-ene
CID 142168819
N,4-dimethyl-N-(methylideneamino)hex-1-en-2-amine;ethanol
CID 156832197
(3Z)-N,3,6-trimethyl-N-(methylideneamino)hepta-1,3,5-trien-2-amine
CID 166786271
2-[methyl-(methylideneamino)amino]prop-2-enenitrile
CID 126564399
N-[(E)-2-methylpent-1-enyl]methanimine
CID 142044769
(E)-N,2-dimethyl-N-(methylideneamino)but-2-en-1-amine
CID 142890314
N-methyl-2-methylidene-N-(methylideneamino)butan-1-amine
CID 155350403
N,N-dimethylmethanamine;methane;2-methylprop-1-ene;propane
CID 158386035
CID 171375325
CID 171375325
butane;ethane;2-methylbut-1-ene
CID 142050807
1-methyl-1-(3-methylbut-2-en-2-yl)hydrazine
CID 123438969

Frequently Asked Questions

What is the IUPAC name of butane;N,3-dimethyl-N-(methylideneamino)but-2-en-2-amine?
The IUPAC name of butane;N,3-dimethyl-N-(methylideneamino)but-2-en-2-amine (CID 143436388) is butane;N,3-dimethyl-N-(methylideneamino)but-2-en-2-amine.
What is the SMILES notation for butane;N,3-dimethyl-N-(methylideneamino)but-2-en-2-amine?
The canonical SMILES for butane;N,3-dimethyl-N-(methylideneamino)but-2-en-2-amine is C=NN(C)C(C)=C(C)C.CCCC.
What is the InChIKey of butane;N,3-dimethyl-N-(methylideneamino)but-2-en-2-amine?
The InChIKey is NKMGAHWTLRYTPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2.C4H10/c1-6(2)7(3)9(5)8-4;1-3-4-2/h4H2,1-3,5H3;3-4H2,1-2H3.
What are the key properties of butane;N,3-dimethyl-N-(methylideneamino)but-2-en-2-amine?
butane;N,3-dimethyl-N-(methylideneamino)but-2-en-2-amine has a molecular weight of 184.33 g/mol, XLogP of 3.65, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for butane;N,3-dimethyl-N-(methylideneamino)but-2-en-2-amine is sourced from PubChem (CID 143436388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).