sodium;N-ethylprop-2-en-1-amine;hydride

C5H12NNa — CID 173234565

IUPACsodium;N-ethylprop-2-en-1-amine;hydride
SMILESC=CCNCC.[H-].[Na+]
InChIInChI=1S/C5H11N.Na.H/c1-3-5-6-4-2;;/h3,6H,1,4-5H2,2H3;;/q;+1;-1
InChIKeyINBQPBBLSYMDTA-UHFFFAOYSA-N
MW109.15 g/mol
LogP-2.10
Rot. Bonds3

About sodium;N-ethylprop-2-en-1-amine;hydride

sodium;N-ethylprop-2-en-1-amine;hydride (PubChem CID 173234565) has the molecular formula C5H12NNa and a molecular weight of 109.15 g/mol. Its IUPAC name is sodium;N-ethylprop-2-en-1-amine;hydride.

Molecular Properties

Compound Namesodium;N-ethylprop-2-en-1-amine;hydride
PubChem CID173234565
Molecular FormulaC5H12NNa
Molecular Weight109.15 g/mol
Exact Mass109.09
IUPAC Namesodium;N-ethylprop-2-en-1-amine;hydride
SMILESC=CCNCC.[H-].[Na+]
InChIInChI=1S/C5H11N.Na.H/c1-3-5-6-4-2;;/h3,6H,1,4-5H2,2H3;;/q;+1;-1
InChIKeyINBQPBBLSYMDTA-UHFFFAOYSA-N
XLogP-2.10
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500109.15
LogP ≤ 5-2.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

sodium;hydride;N-prop-2-enylprop-2-en-1-amine
CID 173095987
sodium;2-(ethylamino)acetaldehyde;hydride
CID 173371347
N-prop-2-enylprop-2-en-1-amine;dihydrochloride
CID 23073046
N-prop-2-enylprop-2-en-1-amine;hydrofluoride
CID 86146928
N-ethylprop-2-en-1-amine;ethyl(prop-2-enyl)carbamodithioic acid
CID 88674834
N-prop-2-enyltridecan-1-amine
CID 22467882
N,N'-bis(prop-2-enyl)decane-1,10-diamine
CID 118539136
2-(ethylamino)ethanethial
CID 22995262
2-(ethylamino)ethylidenevanadium
CID 145023403
2,3-dimethyl-N-prop-2-enylpentan-1-amine
CID 10057996
2-N,2-N-diethyl-1-N-prop-2-enylpropane-1,2-diamine
CID 62557121
oxirane;N-prop-2-enylprop-2-en-1-amine
CID 174833487

Frequently Asked Questions

What is the IUPAC name of sodium;N-ethylprop-2-en-1-amine;hydride?
The IUPAC name of sodium;N-ethylprop-2-en-1-amine;hydride (CID 173234565) is sodium;N-ethylprop-2-en-1-amine;hydride.
What is the SMILES notation for sodium;N-ethylprop-2-en-1-amine;hydride?
The canonical SMILES for sodium;N-ethylprop-2-en-1-amine;hydride is C=CCNCC.[H-].[Na+].
What is the InChIKey of sodium;N-ethylprop-2-en-1-amine;hydride?
The InChIKey is INBQPBBLSYMDTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11N.Na.H/c1-3-5-6-4-2;;/h3,6H,1,4-5H2,2H3;;/q;+1;-1.
What are the key properties of sodium;N-ethylprop-2-en-1-amine;hydride?
sodium;N-ethylprop-2-en-1-amine;hydride has a molecular weight of 109.15 g/mol, XLogP of -2.10, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;N-ethylprop-2-en-1-amine;hydride is sourced from PubChem (CID 173234565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).