2-(1-cyclopentyltetrazol-5-yl)sulfanyl-N-(2-morpholin-4-ylphenyl)acetamide

C18H24N6O2S — CID 1383754

IUPAC2-(1-cyclopentyltetrazol-5-yl)sulfanyl-N-(2-morpholin-4-ylphenyl)acetamide
SMILESO=C(CSc1nnnn1C1CCCC1)Nc1ccccc1N1CCOCC1
InChIInChI=1S/C18H24N6O2S/c25-17(13-27-18-20-21-22-24(18)14-5-1-2-6-14)19-15-7-3-4-8-16(15)23-9-11-26-12-10-23/h3-4,7-8,14H,1-2,5-6,9-13H2,(H,19,25)
InChIKeyWELIUGZLUCMDPD-UHFFFAOYSA-N
MW388.50 g/mol
LogP2.36
Rot. Bonds6

About 2-(1-cyclopentyltetrazol-5-yl)sulfanyl-N-(2-morpholin-4-ylphenyl)acetamide

2-(1-cyclopentyltetrazol-5-yl)sulfanyl-N-(2-morpholin-4-ylphenyl)acetamide (PubChem CID 1383754) has the molecular formula C18H24N6O2S and a molecular weight of 388.50 g/mol. Its IUPAC name is 2-(1-cyclopentyltetrazol-5-yl)sulfanyl-N-(2-morpholin-4-ylphenyl)acetamide.

Molecular Properties

Compound Name2-(1-cyclopentyltetrazol-5-yl)sulfanyl-N-(2-morpholin-4-ylphenyl)acetamide
PubChem CID1383754
Molecular FormulaC18H24N6O2S
Molecular Weight388.50 g/mol
Exact Mass388.17
IUPAC Name2-(1-cyclopentyltetrazol-5-yl)sulfanyl-N-(2-morpholin-4-ylphenyl)acetamide
SMILESO=C(CSc1nnnn1C1CCCC1)Nc1ccccc1N1CCOCC1
InChIInChI=1S/C18H24N6O2S/c25-17(13-27-18-20-21-22-24(18)14-5-1-2-6-14)19-15-7-3-4-8-16(15)23-9-11-26-12-10-23/h3-4,7-8,14H,1-2,5-6,9-13H2,(H,19,25)
InChIKeyWELIUGZLUCMDPD-UHFFFAOYSA-N
XLogP2.36
TPSA85.17 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.50
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

2-[(1-ethyl-1H-1,2,3,4-tetraazol-5-yl)sulfanyl]-1-(4-phenylpiperazino)-1-ethanone
CID 2810020
N-{3-[2-(1-Cyclopentyl-1H-tetrazol-5-ylsulfanyl)-acetylamino]-phenyl}-propionamide
CID 645548
2-(1-Isopropyl-1H-tetrazol-5-ylsulfanyl)-N-(2-morpholin-4-yl-phenyl)-acetamide
CID 645894
2-(1-Methyl-1H-tetrazol-5-ylsulfanyl)-N-(2-morpholin-4-yl-phenyl)-acetamide
CID 647118
2-(1-Methyl-1H-tetrazol-5-ylsulfanyl)-N-(2-piperidin-1-yl-phenyl)-acetamide
CID 652811
1-{3-(morpholin-4-yl)-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]propyl}pyrrolidin-2-one
CID 659756
1-Morpholin-4-yl-3-(1-phenyltetrazol-5-yl)sulfanylpropan-1-one
CID 851331
2-[[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-piperidin-1-ylphenyl)acetamide
CID 4789868
4-[2-(1-Cyclopropyltetrazol-5-yl)sulfanylacetyl]-1,3-dihydroquinoxalin-2-one
CID 9361830
4-[2-(1-cyclopropyltetrazol-5-yl)sulfanylpropanoyl]-3,3-dimethyl-1H-quinoxalin-2-one
CID 16329167
2-(1-methyltetrazol-5-yl)sulfanyl-N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]acetamide
CID 2335219
N-(4-morpholin-4-ylphenyl)-2-(1-phenyltetrazol-5-yl)sulfanylacetamide
CID 2621309

Frequently Asked Questions

What is the IUPAC name of 2-(1-cyclopentyltetrazol-5-yl)sulfanyl-N-(2-morpholin-4-ylphenyl)acetamide?
The IUPAC name of 2-(1-cyclopentyltetrazol-5-yl)sulfanyl-N-(2-morpholin-4-ylphenyl)acetamide (CID 1383754) is 2-(1-cyclopentyltetrazol-5-yl)sulfanyl-N-(2-morpholin-4-ylphenyl)acetamide.
What is the SMILES notation for 2-(1-cyclopentyltetrazol-5-yl)sulfanyl-N-(2-morpholin-4-ylphenyl)acetamide?
The canonical SMILES for 2-(1-cyclopentyltetrazol-5-yl)sulfanyl-N-(2-morpholin-4-ylphenyl)acetamide is O=C(CSc1nnnn1C1CCCC1)Nc1ccccc1N1CCOCC1.
What is the InChIKey of 2-(1-cyclopentyltetrazol-5-yl)sulfanyl-N-(2-morpholin-4-ylphenyl)acetamide?
The InChIKey is WELIUGZLUCMDPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N6O2S/c25-17(13-27-18-20-21-22-24(18)14-5-1-2-6-14)19-15-7-3-4-8-16(15)23-9-11-26-12-10-23/h3-4,7-8,14H,1-2,5-6,9-13H2,(H,19,25).
What are the key properties of 2-(1-cyclopentyltetrazol-5-yl)sulfanyl-N-(2-morpholin-4-ylphenyl)acetamide?
2-(1-cyclopentyltetrazol-5-yl)sulfanyl-N-(2-morpholin-4-ylphenyl)acetamide has a molecular weight of 388.50 g/mol, XLogP of 2.36, 6 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-cyclopentyltetrazol-5-yl)sulfanyl-N-(2-morpholin-4-ylphenyl)acetamide is sourced from PubChem (CID 1383754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).