1-(3-methylcyclopentyl)-2-(2-methyltetrazol-5-yl)ethanamine

C10H19N5 — CID 107049550

IUPAC1-(3-methylcyclopentyl)-2-(2-methyltetrazol-5-yl)ethanamine
SMILESCC1CCC(C(N)Cc2nnn(C)n2)C1
InChIInChI=1S/C10H19N5/c1-7-3-4-8(5-7)9(11)6-10-12-14-15(2)13-10/h7-9H,3-6,11H2,1-2H3
InChIKeyJJEDKXISMVDSIV-UHFFFAOYSA-N
MW209.30 g/mol
LogP0.52
Rot. Bonds3

About 1-(3-methylcyclopentyl)-2-(2-methyltetrazol-5-yl)ethanamine

1-(3-methylcyclopentyl)-2-(2-methyltetrazol-5-yl)ethanamine (PubChem CID 107049550) has the molecular formula C10H19N5 and a molecular weight of 209.30 g/mol. Its IUPAC name is 1-(3-methylcyclopentyl)-2-(2-methyltetrazol-5-yl)ethanamine.

Molecular Properties

Compound Name1-(3-methylcyclopentyl)-2-(2-methyltetrazol-5-yl)ethanamine
PubChem CID107049550
Molecular FormulaC10H19N5
Molecular Weight209.30 g/mol
Exact Mass209.16
IUPAC Name1-(3-methylcyclopentyl)-2-(2-methyltetrazol-5-yl)ethanamine
SMILESCC1CCC(C(N)Cc2nnn(C)n2)C1
InChIInChI=1S/C10H19N5/c1-7-3-4-8(5-7)9(11)6-10-12-14-15(2)13-10/h7-9H,3-6,11H2,1-2H3
InChIKeyJJEDKXISMVDSIV-UHFFFAOYSA-N
XLogP0.52
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.30
LogP ≤ 50.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(3-methylcyclopentyl)-2-(2-methyltetrazol-5-yl)ethanamine?
The IUPAC name of 1-(3-methylcyclopentyl)-2-(2-methyltetrazol-5-yl)ethanamine (CID 107049550) is 1-(3-methylcyclopentyl)-2-(2-methyltetrazol-5-yl)ethanamine.
What is the SMILES notation for 1-(3-methylcyclopentyl)-2-(2-methyltetrazol-5-yl)ethanamine?
The canonical SMILES for 1-(3-methylcyclopentyl)-2-(2-methyltetrazol-5-yl)ethanamine is CC1CCC(C(N)Cc2nnn(C)n2)C1.
What is the InChIKey of 1-(3-methylcyclopentyl)-2-(2-methyltetrazol-5-yl)ethanamine?
The InChIKey is JJEDKXISMVDSIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N5/c1-7-3-4-8(5-7)9(11)6-10-12-14-15(2)13-10/h7-9H,3-6,11H2,1-2H3.
What are the key properties of 1-(3-methylcyclopentyl)-2-(2-methyltetrazol-5-yl)ethanamine?
1-(3-methylcyclopentyl)-2-(2-methyltetrazol-5-yl)ethanamine has a molecular weight of 209.30 g/mol, XLogP of 0.52, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methylcyclopentyl)-2-(2-methyltetrazol-5-yl)ethanamine is sourced from PubChem (CID 107049550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).