1-[1-(1-phenyltetrazol-5-yl)piperidin-3-yl]imidazolidin-2-one

C15H19N7O — CID 133314224

IUPAC1-[1-(1-phenyltetrazol-5-yl)piperidin-3-yl]imidazolidin-2-one
SMILESO=C1NCCN1C1CCCN(c2nnnn2-c2ccccc2)C1
InChIInChI=1S/C15H19N7O/c23-15-16-8-10-21(15)13-7-4-9-20(11-13)14-17-18-19-22(14)12-5-2-1-3-6-12/h1-3,5-6,13H,4,7-11H2,(H,16,23)
InChIKeyUKADBDPIXVSRDZ-UHFFFAOYSA-N
MW313.36 g/mol
LogP0.66
Rot. Bonds3

About 1-[1-(1-phenyltetrazol-5-yl)piperidin-3-yl]imidazolidin-2-one

1-[1-(1-phenyltetrazol-5-yl)piperidin-3-yl]imidazolidin-2-one (PubChem CID 133314224) has the molecular formula C15H19N7O and a molecular weight of 313.36 g/mol. Its IUPAC name is 1-[1-(1-phenyltetrazol-5-yl)piperidin-3-yl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[1-(1-phenyltetrazol-5-yl)piperidin-3-yl]imidazolidin-2-one
PubChem CID133314224
Molecular FormulaC15H19N7O
Molecular Weight313.36 g/mol
Exact Mass313.17
IUPAC Name1-[1-(1-phenyltetrazol-5-yl)piperidin-3-yl]imidazolidin-2-one
SMILESO=C1NCCN1C1CCCN(c2nnnn2-c2ccccc2)C1
InChIInChI=1S/C15H19N7O/c23-15-16-8-10-21(15)13-7-4-9-20(11-13)14-17-18-19-22(14)12-5-2-1-3-6-12/h1-3,5-6,13H,4,7-11H2,(H,16,23)
InChIKeyUKADBDPIXVSRDZ-UHFFFAOYSA-N
XLogP0.66
TPSA79.18 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.36
LogP ≤ 50.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-(1-phenyltetrazol-5-yl)piperidin-3-ol
CID 18074907
(3R)-1-(1-phenyltetrazol-5-yl)piperidin-3-amine
CID 102986512
N-methyl-1-(1-phenyltetrazol-5-yl)piperidin-3-amine
CID 55084372
1-phenyl-5-[(3S)-3-pyrrolidin-1-ylpyrrolidin-1-yl]tetrazole
CID 97262694
4-ethyl-3-[(3S)-1-(1-phenyltetrazol-5-yl)piperidin-3-yl]-1H-1,2,4-triazol-5-one
CID 95204094
(4aR,8aS)-6-(1-phenyltetrazol-5-yl)-2,3,4,4a,5,7,8,8a-octahydro-1H-1,6-naphthyridine
CID 154823989
3-[1-(1-phenyltetrazol-5-yl)piperidin-3-yl]-[1,2,4]triazolo[4,3-a]pyridine
CID 17418452
1-cyclopropyl-4-(1-phenyltetrazol-5-yl)piperazine
CID 47453668
methyl 2-methyl-2-[1-(1-phenyltetrazol-5-yl)piperidin-3-yl]propanoate
CID 133444460
1-(1-benzylpiperidin-3-yl)imidazolidin-2-one
CID 78980069
1-[[(3R)-1-(1-phenyltetrazol-5-yl)piperidin-3-yl]methyl]triazole-4-carboxylic acid
CID 95191744
9-(1-phenyltetrazol-5-yl)-1-oxa-3,9-diazaspiro[4.6]undecan-2-one
CID 56884136

Frequently Asked Questions

What is the IUPAC name of 1-[1-(1-phenyltetrazol-5-yl)piperidin-3-yl]imidazolidin-2-one?
The IUPAC name of 1-[1-(1-phenyltetrazol-5-yl)piperidin-3-yl]imidazolidin-2-one (CID 133314224) is 1-[1-(1-phenyltetrazol-5-yl)piperidin-3-yl]imidazolidin-2-one.
What is the SMILES notation for 1-[1-(1-phenyltetrazol-5-yl)piperidin-3-yl]imidazolidin-2-one?
The canonical SMILES for 1-[1-(1-phenyltetrazol-5-yl)piperidin-3-yl]imidazolidin-2-one is O=C1NCCN1C1CCCN(c2nnnn2-c2ccccc2)C1.
What is the InChIKey of 1-[1-(1-phenyltetrazol-5-yl)piperidin-3-yl]imidazolidin-2-one?
The InChIKey is UKADBDPIXVSRDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N7O/c23-15-16-8-10-21(15)13-7-4-9-20(11-13)14-17-18-19-22(14)12-5-2-1-3-6-12/h1-3,5-6,13H,4,7-11H2,(H,16,23).
What are the key properties of 1-[1-(1-phenyltetrazol-5-yl)piperidin-3-yl]imidazolidin-2-one?
1-[1-(1-phenyltetrazol-5-yl)piperidin-3-yl]imidazolidin-2-one has a molecular weight of 313.36 g/mol, XLogP of 0.66, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(1-phenyltetrazol-5-yl)piperidin-3-yl]imidazolidin-2-one is sourced from PubChem (CID 133314224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).