1-(2-methyltetrazol-5-yl)-N-propylpent-4-en-2-amine

C10H19N5 — CID 107050928

IUPAC1-(2-methyltetrazol-5-yl)-N-propylpent-4-en-2-amine
SMILESC=CCC(Cc1nnn(C)n1)NCCC
InChIInChI=1S/C10H19N5/c1-4-6-9(11-7-5-2)8-10-12-14-15(3)13-10/h4,9,11H,1,5-8H2,2-3H3
InChIKeyWNSQSWDKXAOECP-UHFFFAOYSA-N
MW209.30 g/mol
LogP0.70
Rot. Bonds7

About 1-(2-methyltetrazol-5-yl)-N-propylpent-4-en-2-amine

1-(2-methyltetrazol-5-yl)-N-propylpent-4-en-2-amine (PubChem CID 107050928) has the molecular formula C10H19N5 and a molecular weight of 209.30 g/mol. Its IUPAC name is 1-(2-methyltetrazol-5-yl)-N-propylpent-4-en-2-amine.

Molecular Properties

Compound Name1-(2-methyltetrazol-5-yl)-N-propylpent-4-en-2-amine
PubChem CID107050928
Molecular FormulaC10H19N5
Molecular Weight209.30 g/mol
Exact Mass209.16
IUPAC Name1-(2-methyltetrazol-5-yl)-N-propylpent-4-en-2-amine
SMILESC=CCC(Cc1nnn(C)n1)NCCC
InChIInChI=1S/C10H19N5/c1-4-6-9(11-7-5-2)8-10-12-14-15(3)13-10/h4,9,11H,1,5-8H2,2-3H3
InChIKeyWNSQSWDKXAOECP-UHFFFAOYSA-N
XLogP0.70
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.30
LogP ≤ 50.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methyltetrazol-5-yl)-N-propylpent-4-en-2-amine?
The IUPAC name of 1-(2-methyltetrazol-5-yl)-N-propylpent-4-en-2-amine (CID 107050928) is 1-(2-methyltetrazol-5-yl)-N-propylpent-4-en-2-amine.
What is the SMILES notation for 1-(2-methyltetrazol-5-yl)-N-propylpent-4-en-2-amine?
The canonical SMILES for 1-(2-methyltetrazol-5-yl)-N-propylpent-4-en-2-amine is C=CCC(Cc1nnn(C)n1)NCCC.
What is the InChIKey of 1-(2-methyltetrazol-5-yl)-N-propylpent-4-en-2-amine?
The InChIKey is WNSQSWDKXAOECP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N5/c1-4-6-9(11-7-5-2)8-10-12-14-15(3)13-10/h4,9,11H,1,5-8H2,2-3H3.
What are the key properties of 1-(2-methyltetrazol-5-yl)-N-propylpent-4-en-2-amine?
1-(2-methyltetrazol-5-yl)-N-propylpent-4-en-2-amine has a molecular weight of 209.30 g/mol, XLogP of 0.70, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methyltetrazol-5-yl)-N-propylpent-4-en-2-amine is sourced from PubChem (CID 107050928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).