N-ethenylpropan-1-amine;methane

C6H15N — CID 158278470

IUPACN-ethenylpropan-1-amine;methane
SMILESC.C=CNCCC
InChIInChI=1S/C5H11N.CH4/c1-3-5-6-4-2;/h4,6H,2-3,5H2,1H3;1H4
InChIKeyGJXHWJCGXGNCIF-UHFFFAOYSA-N
MW101.19 g/mol
LogP1.77
Rot. Bonds3

About N-ethenylpropan-1-amine;methane

N-ethenylpropan-1-amine;methane (PubChem CID 158278470) has the molecular formula C6H15N and a molecular weight of 101.19 g/mol. Its IUPAC name is N-ethenylpropan-1-amine;methane.

Molecular Properties

Compound NameN-ethenylpropan-1-amine;methane
PubChem CID158278470
Molecular FormulaC6H15N
Molecular Weight101.19 g/mol
Exact Mass101.12
IUPAC NameN-ethenylpropan-1-amine;methane
SMILESC.C=CNCCC
InChIInChI=1S/C5H11N.CH4/c1-3-5-6-4-2;/h4,6H,2-3,5H2,1H3;1H4
InChIKeyGJXHWJCGXGNCIF-UHFFFAOYSA-N
XLogP1.77
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500101.19
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-ethenylpentan-1-amine
CID 87131661
N-ethenyltetradecan-1-amine
CID 175788828
2-dimethylphosphoryl-N-ethenylethanamine
CID 170130090
benzyl acetate;N-ethenylpropan-1-amine
CID 161342303
N-ethenylpent-4-en-1-amine
CID 142515999
4-dimethylsilyl-N-ethenylbutan-1-amine
CID 154083369
3-methyl-2-prop-1-en-2-yl-N-propylbuta-1,3-dien-1-amine
CID 170028248
N-[(2-methylideneaziridin-1-ium-1-ylidene)methyl]propan-1-amine
CID 91150065
(Z)-N-ethenyl-4-methylhex-4-en-1-amine
CID 170086323
N-silylpropan-1-amine
CID 123593854
N-(2-methylphosphanylethenyl)propan-1-amine
CID 129054103
N-ethenylhept-6-en-1-amine
CID 145124117

Frequently Asked Questions

What is the IUPAC name of N-ethenylpropan-1-amine;methane?
The IUPAC name of N-ethenylpropan-1-amine;methane (CID 158278470) is N-ethenylpropan-1-amine;methane.
What is the SMILES notation for N-ethenylpropan-1-amine;methane?
The canonical SMILES for N-ethenylpropan-1-amine;methane is C.C=CNCCC.
What is the InChIKey of N-ethenylpropan-1-amine;methane?
The InChIKey is GJXHWJCGXGNCIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11N.CH4/c1-3-5-6-4-2;/h4,6H,2-3,5H2,1H3;1H4.
What are the key properties of N-ethenylpropan-1-amine;methane?
N-ethenylpropan-1-amine;methane has a molecular weight of 101.19 g/mol, XLogP of 1.77, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenylpropan-1-amine;methane is sourced from PubChem (CID 158278470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).