1-methyl-N-[1-(oxolan-2-yl)ethyl]tetrazol-5-amine

C8H15N5O — CID 63152460

IUPAC1-methyl-N-[1-(oxolan-2-yl)ethyl]tetrazol-5-amine
SMILESCC(Nc1nnnn1C)C1CCCO1
InChIInChI=1S/C8H15N5O/c1-6(7-4-3-5-14-7)9-8-10-11-12-13(8)2/h6-7H,3-5H2,1-2H3,(H,9,10,12)
InChIKeyTUKVYCFJMQVHMG-UHFFFAOYSA-N
MW197.24 g/mol
LogP0.19
Rot. Bonds3

About 1-methyl-N-[1-(oxolan-2-yl)ethyl]tetrazol-5-amine

1-methyl-N-[1-(oxolan-2-yl)ethyl]tetrazol-5-amine (PubChem CID 63152460) has the molecular formula C8H15N5O and a molecular weight of 197.24 g/mol. Its IUPAC name is 1-methyl-N-[1-(oxolan-2-yl)ethyl]tetrazol-5-amine.

Molecular Properties

Compound Name1-methyl-N-[1-(oxolan-2-yl)ethyl]tetrazol-5-amine
PubChem CID63152460
Molecular FormulaC8H15N5O
Molecular Weight197.24 g/mol
Exact Mass197.13
IUPAC Name1-methyl-N-[1-(oxolan-2-yl)ethyl]tetrazol-5-amine
SMILESCC(Nc1nnnn1C)C1CCCO1
InChIInChI=1S/C8H15N5O/c1-6(7-4-3-5-14-7)9-8-10-11-12-13(8)2/h6-7H,3-5H2,1-2H3,(H,9,10,12)
InChIKeyTUKVYCFJMQVHMG-UHFFFAOYSA-N
XLogP0.19
TPSA64.86 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.24
LogP ≤ 50.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-[1-(oxolan-2-yl)ethyl]tetrazol-5-amine?
The IUPAC name of 1-methyl-N-[1-(oxolan-2-yl)ethyl]tetrazol-5-amine (CID 63152460) is 1-methyl-N-[1-(oxolan-2-yl)ethyl]tetrazol-5-amine.
What is the SMILES notation for 1-methyl-N-[1-(oxolan-2-yl)ethyl]tetrazol-5-amine?
The canonical SMILES for 1-methyl-N-[1-(oxolan-2-yl)ethyl]tetrazol-5-amine is CC(Nc1nnnn1C)C1CCCO1.
What is the InChIKey of 1-methyl-N-[1-(oxolan-2-yl)ethyl]tetrazol-5-amine?
The InChIKey is TUKVYCFJMQVHMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N5O/c1-6(7-4-3-5-14-7)9-8-10-11-12-13(8)2/h6-7H,3-5H2,1-2H3,(H,9,10,12).
What are the key properties of 1-methyl-N-[1-(oxolan-2-yl)ethyl]tetrazol-5-amine?
1-methyl-N-[1-(oxolan-2-yl)ethyl]tetrazol-5-amine has a molecular weight of 197.24 g/mol, XLogP of 0.19, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[1-(oxolan-2-yl)ethyl]tetrazol-5-amine is sourced from PubChem (CID 63152460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).