2-[5-[(2-methyltetrazol-5-yl)methoxy]-2-pyridinyl]ethanamine

C10H14N6O — CID 107051908

IUPAC2-[5-[(2-methyltetrazol-5-yl)methoxy]-2-pyridinyl]ethanamine
SMILESCn1nnc(COc2ccc(CCN)nc2)n1
InChIInChI=1S/C10H14N6O/c1-16-14-10(13-15-16)7-17-9-3-2-8(4-5-11)12-6-9/h2-3,6H,4-5,7,11H2,1H3
InChIKeyFRPOORCKKYUAFT-UHFFFAOYSA-N
MW234.26 g/mol
LogP-0.31
Rot. Bonds5

About 2-[5-[(2-methyltetrazol-5-yl)methoxy]-2-pyridinyl]ethanamine

2-[5-[(2-methyltetrazol-5-yl)methoxy]-2-pyridinyl]ethanamine (PubChem CID 107051908) has the molecular formula C10H14N6O and a molecular weight of 234.26 g/mol. Its IUPAC name is 2-[5-[(2-methyltetrazol-5-yl)methoxy]-2-pyridinyl]ethanamine.

Molecular Properties

Compound Name2-[5-[(2-methyltetrazol-5-yl)methoxy]-2-pyridinyl]ethanamine
PubChem CID107051908
Molecular FormulaC10H14N6O
Molecular Weight234.26 g/mol
Exact Mass234.12
IUPAC Name2-[5-[(2-methyltetrazol-5-yl)methoxy]-2-pyridinyl]ethanamine
SMILESCn1nnc(COc2ccc(CCN)nc2)n1
InChIInChI=1S/C10H14N6O/c1-16-14-10(13-15-16)7-17-9-3-2-8(4-5-11)12-6-9/h2-3,6H,4-5,7,11H2,1H3
InChIKeyFRPOORCKKYUAFT-UHFFFAOYSA-N
XLogP-0.31
TPSA91.74 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.26
LogP ≤ 5-0.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-[5-[(2-methyltetrazol-5-yl)methoxy]-2-pyridinyl]ethanamine?
The IUPAC name of 2-[5-[(2-methyltetrazol-5-yl)methoxy]-2-pyridinyl]ethanamine (CID 107051908) is 2-[5-[(2-methyltetrazol-5-yl)methoxy]-2-pyridinyl]ethanamine.
What is the SMILES notation for 2-[5-[(2-methyltetrazol-5-yl)methoxy]-2-pyridinyl]ethanamine?
The canonical SMILES for 2-[5-[(2-methyltetrazol-5-yl)methoxy]-2-pyridinyl]ethanamine is Cn1nnc(COc2ccc(CCN)nc2)n1.
What is the InChIKey of 2-[5-[(2-methyltetrazol-5-yl)methoxy]-2-pyridinyl]ethanamine?
The InChIKey is FRPOORCKKYUAFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N6O/c1-16-14-10(13-15-16)7-17-9-3-2-8(4-5-11)12-6-9/h2-3,6H,4-5,7,11H2,1H3.
What are the key properties of 2-[5-[(2-methyltetrazol-5-yl)methoxy]-2-pyridinyl]ethanamine?
2-[5-[(2-methyltetrazol-5-yl)methoxy]-2-pyridinyl]ethanamine has a molecular weight of 234.26 g/mol, XLogP of -0.31, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-[(2-methyltetrazol-5-yl)methoxy]-2-pyridinyl]ethanamine is sourced from PubChem (CID 107051908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).