4-[(R)-(1-cyclopentyltetrazol-5-yl)-thiophen-2-ylmethyl]morpholin-4-ium

C15H22N5OS+ — CID 7140874

IUPAC4-[(R)-(1-cyclopentyltetrazol-5-yl)-thiophen-2-ylmethyl]morpholin-4-ium
SMILESc1csc([C@@H](c2nnnn2C2CCCC2)[NH+]2CCOCC2)c1
InChIInChI=1S/C15H21N5OS/c1-2-5-12(4-1)20-15(16-17-18-20)14(13-6-3-11-22-13)19-7-9-21-10-8-19/h3,6,11-12,14H,1-2,4-5,7-10H2/p+1/t14-/m0/s1
InChIKeyJZFZKZOWGMEMGC-AWEZNQCLSA-O
MW320.44 g/mol
LogP0.85
Rot. Bonds4

About 4-[(R)-(1-cyclopentyltetrazol-5-yl)-thiophen-2-ylmethyl]morpholin-4-ium

4-[(R)-(1-cyclopentyltetrazol-5-yl)-thiophen-2-ylmethyl]morpholin-4-ium (PubChem CID 7140874) has the molecular formula C15H22N5OS+ and a molecular weight of 320.44 g/mol. Its IUPAC name is 4-[(R)-(1-cyclopentyltetrazol-5-yl)-thiophen-2-ylmethyl]morpholin-4-ium.

Molecular Properties

Compound Name4-[(R)-(1-cyclopentyltetrazol-5-yl)-thiophen-2-ylmethyl]morpholin-4-ium
PubChem CID7140874
Molecular FormulaC15H22N5OS+
Molecular Weight320.44 g/mol
Exact Mass320.15
IUPAC Name4-[(R)-(1-cyclopentyltetrazol-5-yl)-thiophen-2-ylmethyl]morpholin-4-ium
SMILESc1csc([C@@H](c2nnnn2C2CCCC2)[NH+]2CCOCC2)c1
InChIInChI=1S/C15H21N5OS/c1-2-5-12(4-1)20-15(16-17-18-20)14(13-6-3-11-22-13)19-7-9-21-10-8-19/h3,6,11-12,14H,1-2,4-5,7-10H2/p+1/t14-/m0/s1
InChIKeyJZFZKZOWGMEMGC-AWEZNQCLSA-O
XLogP0.85
TPSA57.27 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.44
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 4-[(R)-(1-cyclopentyltetrazol-5-yl)-thiophen-2-ylmethyl]morpholin-4-ium with MolForge

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Related Compounds

4-[4-[(R)-(1-cyclohexyltetrazol-5-yl)-thiophen-2-ylmethyl]piperazin-4-ium-1-yl]phenol
CID 7140482
1-[(R)-(1-cyclopentyltetrazol-5-yl)-thiophen-2-ylmethyl]-4-(furan-2-ylmethyl)piperazine-1,4-diium
CID 7141025
4-[(R)-(1-cyclopentyltetrazol-5-yl)-pyridin-4-ylmethyl]morpholin-4-ium
CID 6985832
2-[(R)-(1-cyclohexyltetrazol-5-yl)-thiophen-2-ylmethyl]-2-azoniaspiro[5.5]undecane
CID 7140523
4-[(S)-(1-cyclopentyltetrazol-5-yl)-thiophen-2-ylmethyl]morpholine
CID 1438561
4-[(R)-(4-chlorophenyl)-(1-cyclohexyltetrazol-5-yl)methyl]morpholin-4-ium
CID 7140869
4-[(S)-(1-benzyltetrazol-5-yl)-thiophen-2-ylmethyl]morpholin-4-ium
CID 7140876
1-[(R)-(1-cyclopentyltetrazol-5-yl)-phenylmethyl]-4-methylpiperazine-1,4-diium
CID 7383044
3-[(S)-(1-cyclohexyltetrazol-5-yl)-morpholin-4-ium-4-ylmethyl]-5,8-dimethyl-1H-quinolin-2-one
CID 6970920
1-[(R)-(1-cyclopentyltetrazol-5-yl)-phenylmethyl]-4-methylpiperidin-1-ium
CID 7382841
1-[(R)-(1-cyclohexyltetrazol-5-yl)-phenylmethyl]-4-methylpiperidin-1-ium
CID 7382839
1-[(S)-(1-cyclohexyltetrazol-5-yl)-phenylmethyl]-4-methylpiperidin-1-ium
CID 7382838

Frequently Asked Questions

What is the IUPAC name of 4-[(R)-(1-cyclopentyltetrazol-5-yl)-thiophen-2-ylmethyl]morpholin-4-ium?
The IUPAC name of 4-[(R)-(1-cyclopentyltetrazol-5-yl)-thiophen-2-ylmethyl]morpholin-4-ium (CID 7140874) is 4-[(R)-(1-cyclopentyltetrazol-5-yl)-thiophen-2-ylmethyl]morpholin-4-ium.
What is the SMILES notation for 4-[(R)-(1-cyclopentyltetrazol-5-yl)-thiophen-2-ylmethyl]morpholin-4-ium?
The canonical SMILES for 4-[(R)-(1-cyclopentyltetrazol-5-yl)-thiophen-2-ylmethyl]morpholin-4-ium is c1csc([C@@H](c2nnnn2C2CCCC2)[NH+]2CCOCC2)c1.
What is the InChIKey of 4-[(R)-(1-cyclopentyltetrazol-5-yl)-thiophen-2-ylmethyl]morpholin-4-ium?
The InChIKey is JZFZKZOWGMEMGC-AWEZNQCLSA-O. The full InChI is InChI=1S/C15H21N5OS/c1-2-5-12(4-1)20-15(16-17-18-20)14(13-6-3-11-22-13)19-7-9-21-10-8-19/h3,6,11-12,14H,1-2,4-5,7-10H2/p+1/t14-/m0/s1.
What are the key properties of 4-[(R)-(1-cyclopentyltetrazol-5-yl)-thiophen-2-ylmethyl]morpholin-4-ium?
4-[(R)-(1-cyclopentyltetrazol-5-yl)-thiophen-2-ylmethyl]morpholin-4-ium has a molecular weight of 320.44 g/mol, XLogP of 0.85, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(R)-(1-cyclopentyltetrazol-5-yl)-thiophen-2-ylmethyl]morpholin-4-ium is sourced from PubChem (CID 7140874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).