morpholin-4-yl-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]methanone

C16H21N7O2 — CID 17493615

IUPACmorpholin-4-yl-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]methanone
SMILESO=C(N1CCOCC1)N1CCN(c2nnnn2-c2ccccc2)CC1
InChIInChI=1S/C16H21N7O2/c24-16(22-10-12-25-13-11-22)21-8-6-20(7-9-21)15-17-18-19-23(15)14-4-2-1-3-5-14/h1-5H,6-13H2
InChIKeyNSWXKERDIXBODN-UHFFFAOYSA-N
MW343.39 g/mol
LogP0.24
Rot. Bonds2

About morpholin-4-yl-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]methanone

morpholin-4-yl-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]methanone (PubChem CID 17493615) has the molecular formula C16H21N7O2 and a molecular weight of 343.39 g/mol. Its IUPAC name is morpholin-4-yl-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]methanone.

Molecular Properties

Compound Namemorpholin-4-yl-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]methanone
PubChem CID17493615
Molecular FormulaC16H21N7O2
Molecular Weight343.39 g/mol
Exact Mass343.18
IUPAC Namemorpholin-4-yl-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]methanone
SMILESO=C(N1CCOCC1)N1CCN(c2nnnn2-c2ccccc2)CC1
InChIInChI=1S/C16H21N7O2/c24-16(22-10-12-25-13-11-22)21-8-6-20(7-9-21)15-17-18-19-23(15)14-4-2-1-3-5-14/h1-5H,6-13H2
InChIKeyNSWXKERDIXBODN-UHFFFAOYSA-N
XLogP0.24
TPSA79.62 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.39
LogP ≤ 50.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

(2-bromophenyl)-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]methanone
CID 2243329
[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]-(9H-xanthen-9-yl)methanone
CID 46600637
(3-methyl-1,2-oxazol-5-yl)-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]methanone
CID 43073604
2-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]propanoic acid
CID 119924398
1-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]-2-prop-2-enylsulfanylethanone
CID 51086980
N-(4-methylphenyl)-4-(1-phenyltetrazol-5-yl)piperazine-1-carboxamide
CID 134790678
2-bicyclo[2.2.1]heptanyl-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]methanone
CID 55636310
1-methylsulfonyl-4-(1-phenyltetrazol-5-yl)piperazine
CID 27306331
10-[2-oxo-2-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]ethyl]acridin-9-one
CID 43073615
(4-bromo-2-fluorophenyl)-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]methanone
CID 55636432
1-cyclopropyl-4-(1-phenyltetrazol-5-yl)piperazine
CID 47453668
(2-hydroxy-4-propan-2-ylphenyl)-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]methanone
CID 55851808

Frequently Asked Questions

What is the IUPAC name of morpholin-4-yl-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]methanone?
The IUPAC name of morpholin-4-yl-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]methanone (CID 17493615) is morpholin-4-yl-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]methanone.
What is the SMILES notation for morpholin-4-yl-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]methanone?
The canonical SMILES for morpholin-4-yl-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]methanone is O=C(N1CCOCC1)N1CCN(c2nnnn2-c2ccccc2)CC1.
What is the InChIKey of morpholin-4-yl-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]methanone?
The InChIKey is NSWXKERDIXBODN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N7O2/c24-16(22-10-12-25-13-11-22)21-8-6-20(7-9-21)15-17-18-19-23(15)14-4-2-1-3-5-14/h1-5H,6-13H2.
What are the key properties of morpholin-4-yl-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]methanone?
morpholin-4-yl-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]methanone has a molecular weight of 343.39 g/mol, XLogP of 0.24, 2 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]methanone is sourced from PubChem (CID 17493615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).