N-azido-N-prop-2-enylpropan-1-amine

C6H12N4 — CID 90040470

IUPACN-azido-N-prop-2-enylpropan-1-amine
SMILESC=CCN(CCC)N=[N+]=[N-]
InChIInChI=1S/C6H12N4/c1-3-5-10(6-4-2)9-8-7/h3H,1,4-6H2,2H3
InChIKeyGXUIPYDBDXFDRS-UHFFFAOYSA-N
MW140.19 g/mol
LogP2.11
Rot. Bonds5

About N-azido-N-prop-2-enylpropan-1-amine

N-azido-N-prop-2-enylpropan-1-amine (PubChem CID 90040470) has the molecular formula C6H12N4 and a molecular weight of 140.19 g/mol. Its IUPAC name is N-azido-N-prop-2-enylpropan-1-amine.

Molecular Properties

Compound NameN-azido-N-prop-2-enylpropan-1-amine
PubChem CID90040470
Molecular FormulaC6H12N4
Molecular Weight140.19 g/mol
Exact Mass140.11
IUPAC NameN-azido-N-prop-2-enylpropan-1-amine
SMILESC=CCN(CCC)N=[N+]=[N-]
InChIInChI=1S/C6H12N4/c1-3-5-10(6-4-2)9-8-7/h3H,1,4-6H2,2H3
InChIKeyGXUIPYDBDXFDRS-UHFFFAOYSA-N
XLogP2.11
TPSA52.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.19
LogP ≤ 52.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-prop-2-enyl-N-propylpropan-1-amine
CID 527008
1-prop-2-enyl-1-propylhydrazine
CID 87835560
N'-prop-2-enyl-N'-propylethane-1,2-diamine
CID 54159625
N',N'-bis(prop-2-enyl)-N-propylbutane-1,4-diamine
CID 62437868
1,1-dibutyl-2,2-bis(prop-2-enyl)hydrazine
CID 57432921
azidomethane;butane;methanimine;prop-1-ene
CID 162290047
N-prop-2-enylpropan-1-amine;prop-2-enyl(propyl)carbamothioic S-acid
CID 86741157
N,N-bis(prop-2-enyl)undecan-1-amine
CID 10156078
ethane;N-prop-2-enyl-N-propylprop-2-enamide
CID 143794226
N,N-bis[dimethyl(prop-2-enyl)silyl]propan-1-amine;N,N-bis[dimethyl(prop-2-enyl)silyl]prop-2-en-1-amine
CID 161061092
N-prop-2-enyl-N-(prop-2-enylideneamino)prop-2-en-1-amine
CID 534315
ethane;N-ethyl-N-prop-2-enylprop-2-en-1-amine
CID 143235100

Frequently Asked Questions

What is the IUPAC name of N-azido-N-prop-2-enylpropan-1-amine?
The IUPAC name of N-azido-N-prop-2-enylpropan-1-amine (CID 90040470) is N-azido-N-prop-2-enylpropan-1-amine.
What is the SMILES notation for N-azido-N-prop-2-enylpropan-1-amine?
The canonical SMILES for N-azido-N-prop-2-enylpropan-1-amine is C=CCN(CCC)N=[N+]=[N-].
What is the InChIKey of N-azido-N-prop-2-enylpropan-1-amine?
The InChIKey is GXUIPYDBDXFDRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N4/c1-3-5-10(6-4-2)9-8-7/h3H,1,4-6H2,2H3.
What are the key properties of N-azido-N-prop-2-enylpropan-1-amine?
N-azido-N-prop-2-enylpropan-1-amine has a molecular weight of 140.19 g/mol, XLogP of 2.11, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-azido-N-prop-2-enylpropan-1-amine is sourced from PubChem (CID 90040470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).