1-methyl-N-(oxolan-2-ylmethyl)tetrazol-5-amine

C7H13N5O — CID 63152130

IUPAC1-methyl-N-(oxolan-2-ylmethyl)tetrazol-5-amine
SMILESCn1nnnc1NCC1CCCO1
InChIInChI=1S/C7H13N5O/c1-12-7(9-10-11-12)8-5-6-3-2-4-13-6/h6H,2-5H2,1H3,(H,8,9,11)
InChIKeyYGNDQEVUUGTJOT-UHFFFAOYSA-N
MW183.21 g/mol
LogP-0.20
Rot. Bonds3

About 1-methyl-N-(oxolan-2-ylmethyl)tetrazol-5-amine

1-methyl-N-(oxolan-2-ylmethyl)tetrazol-5-amine (PubChem CID 63152130) has the molecular formula C7H13N5O and a molecular weight of 183.21 g/mol. Its IUPAC name is 1-methyl-N-(oxolan-2-ylmethyl)tetrazol-5-amine.

Molecular Properties

Compound Name1-methyl-N-(oxolan-2-ylmethyl)tetrazol-5-amine
PubChem CID63152130
Molecular FormulaC7H13N5O
Molecular Weight183.21 g/mol
Exact Mass183.11
IUPAC Name1-methyl-N-(oxolan-2-ylmethyl)tetrazol-5-amine
SMILESCn1nnnc1NCC1CCCO1
InChIInChI=1S/C7H13N5O/c1-12-7(9-10-11-12)8-5-6-3-2-4-13-6/h6H,2-5H2,1H3,(H,8,9,11)
InChIKeyYGNDQEVUUGTJOT-UHFFFAOYSA-N
XLogP-0.20
TPSA64.86 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.21
LogP ≤ 5-0.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(oxolan-2-ylmethyl)tetrazol-5-amine?
The IUPAC name of 1-methyl-N-(oxolan-2-ylmethyl)tetrazol-5-amine (CID 63152130) is 1-methyl-N-(oxolan-2-ylmethyl)tetrazol-5-amine.
What is the SMILES notation for 1-methyl-N-(oxolan-2-ylmethyl)tetrazol-5-amine?
The canonical SMILES for 1-methyl-N-(oxolan-2-ylmethyl)tetrazol-5-amine is Cn1nnnc1NCC1CCCO1.
What is the InChIKey of 1-methyl-N-(oxolan-2-ylmethyl)tetrazol-5-amine?
The InChIKey is YGNDQEVUUGTJOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N5O/c1-12-7(9-10-11-12)8-5-6-3-2-4-13-6/h6H,2-5H2,1H3,(H,8,9,11).
What are the key properties of 1-methyl-N-(oxolan-2-ylmethyl)tetrazol-5-amine?
1-methyl-N-(oxolan-2-ylmethyl)tetrazol-5-amine has a molecular weight of 183.21 g/mol, XLogP of -0.20, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(oxolan-2-ylmethyl)tetrazol-5-amine is sourced from PubChem (CID 63152130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).