2-phenyl-2-(tetrazolo[1,5-a]pyrazin-5-ylamino)propan-1-ol

C13H14N6O — CID 105058600

IUPAC2-phenyl-2-(tetrazolo[1,5-a]pyrazin-5-ylamino)propan-1-ol
SMILESCC(CO)(Nc1cncc2nnnn12)c1ccccc1
InChIInChI=1S/C13H14N6O/c1-13(9-20,10-5-3-2-4-6-10)15-11-7-14-8-12-16-17-18-19(11)12/h2-8,15,20H,9H2,1H3
InChIKeyGSNQQKXEINCMQE-UHFFFAOYSA-N
MW270.30 g/mol
LogP0.84
Rot. Bonds4

About 2-phenyl-2-(tetrazolo[1,5-a]pyrazin-5-ylamino)propan-1-ol

2-phenyl-2-(tetrazolo[1,5-a]pyrazin-5-ylamino)propan-1-ol (PubChem CID 105058600) has the molecular formula C13H14N6O and a molecular weight of 270.30 g/mol. Its IUPAC name is 2-phenyl-2-(tetrazolo[1,5-a]pyrazin-5-ylamino)propan-1-ol.

Molecular Properties

Compound Name2-phenyl-2-(tetrazolo[1,5-a]pyrazin-5-ylamino)propan-1-ol
PubChem CID105058600
Molecular FormulaC13H14N6O
Molecular Weight270.30 g/mol
Exact Mass270.12
IUPAC Name2-phenyl-2-(tetrazolo[1,5-a]pyrazin-5-ylamino)propan-1-ol
SMILESCC(CO)(Nc1cncc2nnnn12)c1ccccc1
InChIInChI=1S/C13H14N6O/c1-13(9-20,10-5-3-2-4-6-10)15-11-7-14-8-12-16-17-18-19(11)12/h2-8,15,20H,9H2,1H3
InChIKeyGSNQQKXEINCMQE-UHFFFAOYSA-N
XLogP0.84
TPSA88.23 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.30
LogP ≤ 50.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

2-methyl-3-(tetrazolo[1,5-a]pyrazin-5-ylamino)propane-1,2-diol
CID 66170333
3-methyl-3-(tetrazolo[1,5-a]pyrazin-5-ylamino)butanamide
CID 114143012
2-methyl-1-(tetrazolo[1,5-a]pyrazin-5-ylamino)propan-2-ol
CID 63940787
4,4-dimethyl-3-(tetrazolo[1,5-a]pyrazin-5-ylamino)pentan-1-ol
CID 114177083
N-methyl-N'-(tetrazolo[1,5-a]pyrazin-5-yl)ethane-1,2-diamine
CID 62659503
3-phenyl-2-N-(tetrazolo[1,5-a]pyrazin-5-yl)propane-1,2-diamine
CID 63759971
2-[(5-bromo-3-pyridinyl)amino]-2-phenylpropan-1-ol
CID 105058658
2-(imidazo[1,2-a]pyridin-5-ylamino)-2-phenylpropan-1-ol
CID 102625866
N-(2-methoxyethyl)tetrazolo[1,5-a]pyrazin-5-amine
CID 60980965
2-[(tetrazolo[1,5-a]pyrazin-5-ylamino)methyl]butanoic acid
CID 65226474
2-[(5-tert-butyl-2-pyridinyl)amino]-2-phenylpropan-1-ol
CID 107874941
N-[(4-chlorophenyl)methyl]tetrazolo[1,5-a]pyrazin-5-amine
CID 60981108

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-2-(tetrazolo[1,5-a]pyrazin-5-ylamino)propan-1-ol?
The IUPAC name of 2-phenyl-2-(tetrazolo[1,5-a]pyrazin-5-ylamino)propan-1-ol (CID 105058600) is 2-phenyl-2-(tetrazolo[1,5-a]pyrazin-5-ylamino)propan-1-ol.
What is the SMILES notation for 2-phenyl-2-(tetrazolo[1,5-a]pyrazin-5-ylamino)propan-1-ol?
The canonical SMILES for 2-phenyl-2-(tetrazolo[1,5-a]pyrazin-5-ylamino)propan-1-ol is CC(CO)(Nc1cncc2nnnn12)c1ccccc1.
What is the InChIKey of 2-phenyl-2-(tetrazolo[1,5-a]pyrazin-5-ylamino)propan-1-ol?
The InChIKey is GSNQQKXEINCMQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N6O/c1-13(9-20,10-5-3-2-4-6-10)15-11-7-14-8-12-16-17-18-19(11)12/h2-8,15,20H,9H2,1H3.
What are the key properties of 2-phenyl-2-(tetrazolo[1,5-a]pyrazin-5-ylamino)propan-1-ol?
2-phenyl-2-(tetrazolo[1,5-a]pyrazin-5-ylamino)propan-1-ol has a molecular weight of 270.30 g/mol, XLogP of 0.84, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-2-(tetrazolo[1,5-a]pyrazin-5-ylamino)propan-1-ol is sourced from PubChem (CID 105058600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).