8-cyclopropyl-9-[(2-methyltetrazol-5-yl)methyl]-6,9-diazaspiro[4.5]decane

C14H24N6 — CID 107055892

IUPAC8-cyclopropyl-9-[(2-methyltetrazol-5-yl)methyl]-6,9-diazaspiro[4.5]decane
SMILESCn1nnc(CN2CC3(CCCC3)NCC2C2CC2)n1
InChIInChI=1S/C14H24N6/c1-19-17-13(16-18-19)9-20-10-14(6-2-3-7-14)15-8-12(20)11-4-5-11/h11-12,15H,2-10H2,1H3
InChIKeyUWJJIGAGPYHSED-UHFFFAOYSA-N
MW276.39 g/mol
LogP0.71
Rot. Bonds3

About 8-cyclopropyl-9-[(2-methyltetrazol-5-yl)methyl]-6,9-diazaspiro[4.5]decane

8-cyclopropyl-9-[(2-methyltetrazol-5-yl)methyl]-6,9-diazaspiro[4.5]decane (PubChem CID 107055892) has the molecular formula C14H24N6 and a molecular weight of 276.39 g/mol. Its IUPAC name is 8-cyclopropyl-9-[(2-methyltetrazol-5-yl)methyl]-6,9-diazaspiro[4.5]decane.

Molecular Properties

Compound Name8-cyclopropyl-9-[(2-methyltetrazol-5-yl)methyl]-6,9-diazaspiro[4.5]decane
PubChem CID107055892
Molecular FormulaC14H24N6
Molecular Weight276.39 g/mol
Exact Mass276.21
IUPAC Name8-cyclopropyl-9-[(2-methyltetrazol-5-yl)methyl]-6,9-diazaspiro[4.5]decane
SMILESCn1nnc(CN2CC3(CCCC3)NCC2C2CC2)n1
InChIInChI=1S/C14H24N6/c1-19-17-13(16-18-19)9-20-10-14(6-2-3-7-14)15-8-12(20)11-4-5-11/h11-12,15H,2-10H2,1H3
InChIKeyUWJJIGAGPYHSED-UHFFFAOYSA-N
XLogP0.71
TPSA58.87 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.39
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 8-cyclopropyl-9-[(2-methyltetrazol-5-yl)methyl]-6,9-diazaspiro[4.5]decane?
The IUPAC name of 8-cyclopropyl-9-[(2-methyltetrazol-5-yl)methyl]-6,9-diazaspiro[4.5]decane (CID 107055892) is 8-cyclopropyl-9-[(2-methyltetrazol-5-yl)methyl]-6,9-diazaspiro[4.5]decane.
What is the SMILES notation for 8-cyclopropyl-9-[(2-methyltetrazol-5-yl)methyl]-6,9-diazaspiro[4.5]decane?
The canonical SMILES for 8-cyclopropyl-9-[(2-methyltetrazol-5-yl)methyl]-6,9-diazaspiro[4.5]decane is Cn1nnc(CN2CC3(CCCC3)NCC2C2CC2)n1.
What is the InChIKey of 8-cyclopropyl-9-[(2-methyltetrazol-5-yl)methyl]-6,9-diazaspiro[4.5]decane?
The InChIKey is UWJJIGAGPYHSED-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N6/c1-19-17-13(16-18-19)9-20-10-14(6-2-3-7-14)15-8-12(20)11-4-5-11/h11-12,15H,2-10H2,1H3.
What are the key properties of 8-cyclopropyl-9-[(2-methyltetrazol-5-yl)methyl]-6,9-diazaspiro[4.5]decane?
8-cyclopropyl-9-[(2-methyltetrazol-5-yl)methyl]-6,9-diazaspiro[4.5]decane has a molecular weight of 276.39 g/mol, XLogP of 0.71, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 8-cyclopropyl-9-[(2-methyltetrazol-5-yl)methyl]-6,9-diazaspiro[4.5]decane is sourced from PubChem (CID 107055892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).