N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-(tetrazol-1-yl)benzamide

C18H20N6O2S — CID 51931032

IUPACN-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-(tetrazol-1-yl)benzamide
SMILESO=C(NC[C@@H](c1cccs1)N1CCOCC1)c1ccccc1-n1cnnn1
InChIInChI=1S/C18H20N6O2S/c25-18(14-4-1-2-5-15(14)24-13-20-21-22-24)19-12-16(17-6-3-11-27-17)23-7-9-26-10-8-23/h1-6,11,13,16H,7-10,12H2,(H,19,25)/t16-/m0/s1
InChIKeySGDJJDYHMTWRSP-INIZCTEOSA-N
MW384.47 g/mol
LogP1.53
Rot. Bonds6

About N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-(tetrazol-1-yl)benzamide

N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-(tetrazol-1-yl)benzamide (PubChem CID 51931032) has the molecular formula C18H20N6O2S and a molecular weight of 384.47 g/mol. Its IUPAC name is N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-(tetrazol-1-yl)benzamide.

Molecular Properties

Compound NameN-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-(tetrazol-1-yl)benzamide
PubChem CID51931032
Molecular FormulaC18H20N6O2S
Molecular Weight384.47 g/mol
Exact Mass384.14
IUPAC NameN-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-(tetrazol-1-yl)benzamide
SMILESO=C(NC[C@@H](c1cccs1)N1CCOCC1)c1ccccc1-n1cnnn1
InChIInChI=1S/C18H20N6O2S/c25-18(14-4-1-2-5-15(14)24-13-20-21-22-24)19-12-16(17-6-3-11-27-17)23-7-9-26-10-8-23/h1-6,11,13,16H,7-10,12H2,(H,19,25)/t16-/m0/s1
InChIKeySGDJJDYHMTWRSP-INIZCTEOSA-N
XLogP1.53
TPSA85.17 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.47
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-(trifluoromethyl)benzamide
CID 39951261
2-(dimethylamino)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide
CID 167860438
N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)pyridine-4-carboxamide
CID 47007223
N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-oxo-1H-pyridine-3-carboxamide
CID 94180353
1-(2-fluorophenyl)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)pyrazole-3-carboxamide
CID 55650784
4-bromo-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide;hydrochloride
CID 52984970
2-(methanesulfonamido)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide
CID 42940388
2-(methanesulfonamido)-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]benzamide
CID 25335311
N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-thiophen-2-ylquinoline-4-carboxamide
CID 2395138
3-(4-methylphenyl)-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-1-phenylpyrazole-4-carboxamide
CID 30825116
2-fluoro-N-[2-[[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]amino]-2-oxoethyl]benzamide
CID 39951277
5-bromo-N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]thiophene-2-carboxamide
CID 37099503

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-(tetrazol-1-yl)benzamide?
The IUPAC name of N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-(tetrazol-1-yl)benzamide (CID 51931032) is N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-(tetrazol-1-yl)benzamide.
What is the SMILES notation for N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-(tetrazol-1-yl)benzamide?
The canonical SMILES for N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-(tetrazol-1-yl)benzamide is O=C(NC[C@@H](c1cccs1)N1CCOCC1)c1ccccc1-n1cnnn1.
What is the InChIKey of N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-(tetrazol-1-yl)benzamide?
The InChIKey is SGDJJDYHMTWRSP-INIZCTEOSA-N. The full InChI is InChI=1S/C18H20N6O2S/c25-18(14-4-1-2-5-15(14)24-13-20-21-22-24)19-12-16(17-6-3-11-27-17)23-7-9-26-10-8-23/h1-6,11,13,16H,7-10,12H2,(H,19,25)/t16-/m0/s1.
What are the key properties of N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-(tetrazol-1-yl)benzamide?
N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-(tetrazol-1-yl)benzamide has a molecular weight of 384.47 g/mol, XLogP of 1.53, 6 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-(tetrazol-1-yl)benzamide is sourced from PubChem (CID 51931032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).