4-[2-chloro-6-(tetrazol-1-yl)phenyl]morpholine

C11H12ClN5O — CID 16764728

IUPAC4-[2-chloro-6-(tetrazol-1-yl)phenyl]morpholine
SMILESClc1cccc(-n2cnnn2)c1N1CCOCC1
InChIInChI=1S/C11H12ClN5O/c12-9-2-1-3-10(17-8-13-14-15-17)11(9)16-4-6-18-7-5-16/h1-3,8H,4-7H2
InChIKeyJSFUVBPAOPWASB-UHFFFAOYSA-N
MW265.70 g/mol
LogP1.15
Rot. Bonds2

About 4-[2-chloro-6-(tetrazol-1-yl)phenyl]morpholine

4-[2-chloro-6-(tetrazol-1-yl)phenyl]morpholine (PubChem CID 16764728) has the molecular formula C11H12ClN5O and a molecular weight of 265.70 g/mol. Its IUPAC name is 4-[2-chloro-6-(tetrazol-1-yl)phenyl]morpholine.

Molecular Properties

Compound Name4-[2-chloro-6-(tetrazol-1-yl)phenyl]morpholine
PubChem CID16764728
Molecular FormulaC11H12ClN5O
Molecular Weight265.70 g/mol
Exact Mass265.07
IUPAC Name4-[2-chloro-6-(tetrazol-1-yl)phenyl]morpholine
SMILESClc1cccc(-n2cnnn2)c1N1CCOCC1
InChIInChI=1S/C11H12ClN5O/c12-9-2-1-3-10(17-8-13-14-15-17)11(9)16-4-6-18-7-5-16/h1-3,8H,4-7H2
InChIKeyJSFUVBPAOPWASB-UHFFFAOYSA-N
XLogP1.15
TPSA56.07 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.70
LogP ≤ 51.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

4-[1-(3,4-Dichloro-phenyl)-1H-tetrazol-5-ylmethyl]-morpholine
CID 3165813
4-[1-(4-Chloro-phenyl)-1H-tetrazol-5-ylmethyl]-morpholine
CID 3167929
2-(2,3-dichlorophenyl)-N-(2-morpholin-4-ylphenyl)-1,2,4-triazol-3-amine
CID 44453867
1-[3-chloro-2-(pyrrolidin-1-yl)phenyl]-1H-tetrazole
CID 16764726
1-[2-chloro-6-(1H-tetrazol-1-yl)phenyl]piperidine
CID 16764727
3-chloro-2-fluoro-N,N-bis(prop-2-enyl)-6-(tetrazol-1-yl)aniline
CID 156448853
4-[[1-(2,4-Dichlorophenyl)tetrazol-5-yl]methyl]morpholine
CID 89735888
[4-(2,3-Dichlorophenyl)tetrazol-4-ium-1-yl]-morpholin-4-ylmethanone
CID 149699563
N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]-2-morpholin-4-ylacetamide
CID 8903895
N-(5-chloro-2-morpholin-4-ylphenyl)-2-(tetrazol-1-yl)acetamide
CID 17560539
N-(3-chloro-2-morpholin-4-ylphenyl)-2-(tetrazol-1-yl)acetamide
CID 17566621
N-(3-chloro-2-morpholin-4-ylphenyl)-3-(1,2,4-triazol-1-yl)propanamide
CID 24668766

Frequently Asked Questions

What is the IUPAC name of 4-[2-chloro-6-(tetrazol-1-yl)phenyl]morpholine?
The IUPAC name of 4-[2-chloro-6-(tetrazol-1-yl)phenyl]morpholine (CID 16764728) is 4-[2-chloro-6-(tetrazol-1-yl)phenyl]morpholine.
What is the SMILES notation for 4-[2-chloro-6-(tetrazol-1-yl)phenyl]morpholine?
The canonical SMILES for 4-[2-chloro-6-(tetrazol-1-yl)phenyl]morpholine is Clc1cccc(-n2cnnn2)c1N1CCOCC1.
What is the InChIKey of 4-[2-chloro-6-(tetrazol-1-yl)phenyl]morpholine?
The InChIKey is JSFUVBPAOPWASB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12ClN5O/c12-9-2-1-3-10(17-8-13-14-15-17)11(9)16-4-6-18-7-5-16/h1-3,8H,4-7H2.
What are the key properties of 4-[2-chloro-6-(tetrazol-1-yl)phenyl]morpholine?
4-[2-chloro-6-(tetrazol-1-yl)phenyl]morpholine has a molecular weight of 265.70 g/mol, XLogP of 1.15, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-chloro-6-(tetrazol-1-yl)phenyl]morpholine is sourced from PubChem (CID 16764728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).