N-(butylideneamino)-N-methylmethanamine

C6H14N2 — CID 517836

IUPACN-(butylideneamino)-N-methylmethanamine
SMILESCCCC=NN(C)C
InChIInChI=1S/C6H14N2/c1-4-5-6-7-8(2)3/h6H,4-5H2,1-3H3
InChIKeySEEKWDSXURZRIV-UHFFFAOYSA-N
MW114.19 g/mol
LogP1.33
Rot. Bonds3

About N-(butylideneamino)-N-methylmethanamine

N-(butylideneamino)-N-methylmethanamine (PubChem CID 517836) has the molecular formula C6H14N2 and a molecular weight of 114.19 g/mol. Its IUPAC name is N-(butylideneamino)-N-methylmethanamine.

Molecular Properties

Compound NameN-(butylideneamino)-N-methylmethanamine
PubChem CID517836
Molecular FormulaC6H14N2
Molecular Weight114.19 g/mol
Exact Mass114.12
IUPAC NameN-(butylideneamino)-N-methylmethanamine
SMILESCCCC=NN(C)C
InChIInChI=1S/C6H14N2/c1-4-5-6-7-8(2)3/h6H,4-5H2,1-3H3
InChIKeySEEKWDSXURZRIV-UHFFFAOYSA-N
XLogP1.33
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.19
LogP ≤ 51.33
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

Acetaldehyde, 2,2-dimethylhydrazone
CID 6850059
Acetaldehyde dimethylhydrazone
CID 81922
Propanal, dimethylhydrazone
CID 5962214
Propanal dimethylhydrazone
CID 343142
Isobutyraldehyde dimethylhydrazone
CID 518688
Acetaldehyde diethyl hydrazone
CID 522525
Acetalde-hyde dimethylhydrazone
CID 5367989
Butanal, dimethylhydrazone
CID 9601578
Ethanal, ethylmethylhydrazone
CID 18714588
Ethanedial, bis(dimethylhydrazone)
CID 9601560
1-Methyl-4,5-dihydro-1H-pyrazole
CID 13330488
(1E)-Pentanal dimethylhydrazone
CID 518873

Frequently Asked Questions

What is the IUPAC name of N-(butylideneamino)-N-methylmethanamine?
The IUPAC name of N-(butylideneamino)-N-methylmethanamine (CID 517836) is N-(butylideneamino)-N-methylmethanamine.
What is the SMILES notation for N-(butylideneamino)-N-methylmethanamine?
The canonical SMILES for N-(butylideneamino)-N-methylmethanamine is CCCC=NN(C)C.
What is the InChIKey of N-(butylideneamino)-N-methylmethanamine?
The InChIKey is SEEKWDSXURZRIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2/c1-4-5-6-7-8(2)3/h6H,4-5H2,1-3H3.
What are the key properties of N-(butylideneamino)-N-methylmethanamine?
N-(butylideneamino)-N-methylmethanamine has a molecular weight of 114.19 g/mol, XLogP of 1.33, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(butylideneamino)-N-methylmethanamine is sourced from PubChem (CID 517836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).