4-[(1-cyclopentyltetrazol-5-yl)methyl]morpholine

C11H19N5O — CID 861296

IUPAC4-[(1-cyclopentyltetrazol-5-yl)methyl]morpholine
SMILESC1CCC(n2nnnc2CN2CCOCC2)C1
InChIInChI=1S/C11H19N5O/c1-2-4-10(3-1)16-11(12-13-14-16)9-15-5-7-17-8-6-15/h10H,1-9H2
InChIKeyCHUIKHFPVMRJTE-UHFFFAOYSA-N
MW237.31 g/mol
LogP0.62
Rot. Bonds3

About 4-[(1-cyclopentyltetrazol-5-yl)methyl]morpholine

4-[(1-cyclopentyltetrazol-5-yl)methyl]morpholine (PubChem CID 861296) has the molecular formula C11H19N5O and a molecular weight of 237.31 g/mol. Its IUPAC name is 4-[(1-cyclopentyltetrazol-5-yl)methyl]morpholine.

Molecular Properties

Compound Name4-[(1-cyclopentyltetrazol-5-yl)methyl]morpholine
PubChem CID861296
Molecular FormulaC11H19N5O
Molecular Weight237.31 g/mol
Exact Mass237.16
IUPAC Name4-[(1-cyclopentyltetrazol-5-yl)methyl]morpholine
SMILESC1CCC(n2nnnc2CN2CCOCC2)C1
InChIInChI=1S/C11H19N5O/c1-2-4-10(3-1)16-11(12-13-14-16)9-15-5-7-17-8-6-15/h10H,1-9H2
InChIKeyCHUIKHFPVMRJTE-UHFFFAOYSA-N
XLogP0.62
TPSA56.07 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.31
LogP ≤ 50.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-[(1-cyclopentyltetrazol-5-yl)methyl]morpholine?
The IUPAC name of 4-[(1-cyclopentyltetrazol-5-yl)methyl]morpholine (CID 861296) is 4-[(1-cyclopentyltetrazol-5-yl)methyl]morpholine.
What is the SMILES notation for 4-[(1-cyclopentyltetrazol-5-yl)methyl]morpholine?
The canonical SMILES for 4-[(1-cyclopentyltetrazol-5-yl)methyl]morpholine is C1CCC(n2nnnc2CN2CCOCC2)C1.
What is the InChIKey of 4-[(1-cyclopentyltetrazol-5-yl)methyl]morpholine?
The InChIKey is CHUIKHFPVMRJTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5O/c1-2-4-10(3-1)16-11(12-13-14-16)9-15-5-7-17-8-6-15/h10H,1-9H2.
What are the key properties of 4-[(1-cyclopentyltetrazol-5-yl)methyl]morpholine?
4-[(1-cyclopentyltetrazol-5-yl)methyl]morpholine has a molecular weight of 237.31 g/mol, XLogP of 0.62, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(1-cyclopentyltetrazol-5-yl)methyl]morpholine is sourced from PubChem (CID 861296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).