2-(cyclopenten-1-yl)-N-[(2-methyltetrazol-5-yl)methyl]ethanamine

C10H17N5 — CID 106173854

IUPAC2-(cyclopenten-1-yl)-N-[(2-methyltetrazol-5-yl)methyl]ethanamine
SMILESCn1nnc(CNCCC2=CCCC2)n1
InChIInChI=1S/C10H17N5/c1-15-13-10(12-14-15)8-11-7-6-9-4-2-3-5-9/h4,11H,2-3,5-8H2,1H3
InChIKeyTZARHRGMCWQWQB-UHFFFAOYSA-N
MW207.28 g/mol
LogP0.80
Rot. Bonds5

About 2-(cyclopenten-1-yl)-N-[(2-methyltetrazol-5-yl)methyl]ethanamine

2-(cyclopenten-1-yl)-N-[(2-methyltetrazol-5-yl)methyl]ethanamine (PubChem CID 106173854) has the molecular formula C10H17N5 and a molecular weight of 207.28 g/mol. Its IUPAC name is 2-(cyclopenten-1-yl)-N-[(2-methyltetrazol-5-yl)methyl]ethanamine.

Molecular Properties

Compound Name2-(cyclopenten-1-yl)-N-[(2-methyltetrazol-5-yl)methyl]ethanamine
PubChem CID106173854
Molecular FormulaC10H17N5
Molecular Weight207.28 g/mol
Exact Mass207.15
IUPAC Name2-(cyclopenten-1-yl)-N-[(2-methyltetrazol-5-yl)methyl]ethanamine
SMILESCn1nnc(CNCCC2=CCCC2)n1
InChIInChI=1S/C10H17N5/c1-15-13-10(12-14-15)8-11-7-6-9-4-2-3-5-9/h4,11H,2-3,5-8H2,1H3
InChIKeyTZARHRGMCWQWQB-UHFFFAOYSA-N
XLogP0.80
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 50.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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

1-cyclohex-3-en-1-yl-N-[(2-methyltetrazol-5-yl)methyl]methanamine
CID 107042327
2-(cyclohexen-1-yl)-N-[(2-methyltetrazol-5-yl)methyl]ethanamine
CID 107042350
N-[(2-methyltetrazol-5-yl)methyl]cyclohex-3-en-1-amine
CID 107042495
N-[(2-methyltetrazol-5-yl)methyl]cyclopent-3-en-1-amine
CID 107042696
1-(cyclohexen-1-yl)-N-ethyl-3-(2-methyltetrazol-5-yl)propan-2-amine
CID 107050933
1-(cyclohexen-1-yl)-3-(2-methyltetrazol-5-yl)-N-propylpropan-2-amine
CID 107050934
(Z)-N,4-dimethyl-5-(2-methyltetrazol-5-yl)pent-3-en-1-amine
CID 107058736
(Z)-N-ethyl-4-methyl-5-(2-methyltetrazol-5-yl)pent-3-en-1-amine
CID 107058738
(Z)-4-methyl-5-(2-methyltetrazol-5-yl)-N-propylpent-3-en-1-amine
CID 107058742
(Z)-4-methyl-5-(2-methyltetrazol-5-yl)-N-propan-2-ylpent-3-en-1-amine
CID 107058745
N-tert-butyl-4-methyl-5-(2-methyltetrazol-5-yl)pent-3-en-1-amine
CID 107058752
(Z)-4-methyl-N-(2-methylpropyl)-5-(2-methyltetrazol-5-yl)pent-3-en-1-amine
CID 107058756

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopenten-1-yl)-N-[(2-methyltetrazol-5-yl)methyl]ethanamine?
The IUPAC name of 2-(cyclopenten-1-yl)-N-[(2-methyltetrazol-5-yl)methyl]ethanamine (CID 106173854) is 2-(cyclopenten-1-yl)-N-[(2-methyltetrazol-5-yl)methyl]ethanamine.
What is the SMILES notation for 2-(cyclopenten-1-yl)-N-[(2-methyltetrazol-5-yl)methyl]ethanamine?
The canonical SMILES for 2-(cyclopenten-1-yl)-N-[(2-methyltetrazol-5-yl)methyl]ethanamine is Cn1nnc(CNCCC2=CCCC2)n1.
What is the InChIKey of 2-(cyclopenten-1-yl)-N-[(2-methyltetrazol-5-yl)methyl]ethanamine?
The InChIKey is TZARHRGMCWQWQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N5/c1-15-13-10(12-14-15)8-11-7-6-9-4-2-3-5-9/h4,11H,2-3,5-8H2,1H3.
What are the key properties of 2-(cyclopenten-1-yl)-N-[(2-methyltetrazol-5-yl)methyl]ethanamine?
2-(cyclopenten-1-yl)-N-[(2-methyltetrazol-5-yl)methyl]ethanamine has a molecular weight of 207.28 g/mol, XLogP of 0.80, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopenten-1-yl)-N-[(2-methyltetrazol-5-yl)methyl]ethanamine is sourced from PubChem (CID 106173854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).