1-(5-methyltetrazol-2-yl)propan-2-ol

C5H10N4O — CID 13290938

IUPAC1-(5-methyltetrazol-2-yl)propan-2-ol
SMILESCc1nnn(CC(C)O)n1
InChIInChI=1S/C5H10N4O/c1-4(10)3-9-7-5(2)6-8-9/h4,10H,3H2,1-2H3
InChIKeyWYEPTLRGOWQDPP-UHFFFAOYSA-N
MW142.16 g/mol
LogP-0.64
Rot. Bonds2

About 1-(5-methyltetrazol-2-yl)propan-2-ol

1-(5-methyltetrazol-2-yl)propan-2-ol (PubChem CID 13290938) has the molecular formula C5H10N4O and a molecular weight of 142.16 g/mol. Its IUPAC name is 1-(5-methyltetrazol-2-yl)propan-2-ol.

Molecular Properties

Compound Name1-(5-methyltetrazol-2-yl)propan-2-ol
PubChem CID13290938
Molecular FormulaC5H10N4O
Molecular Weight142.16 g/mol
Exact Mass142.09
IUPAC Name1-(5-methyltetrazol-2-yl)propan-2-ol
SMILESCc1nnn(CC(C)O)n1
InChIInChI=1S/C5H10N4O/c1-4(10)3-9-7-5(2)6-8-9/h4,10H,3H2,1-2H3
InChIKeyWYEPTLRGOWQDPP-UHFFFAOYSA-N
XLogP-0.64
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.16
LogP ≤ 5-0.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(5-methyltetrazol-2-yl)propan-2-ol?
The IUPAC name of 1-(5-methyltetrazol-2-yl)propan-2-ol (CID 13290938) is 1-(5-methyltetrazol-2-yl)propan-2-ol.
What is the SMILES notation for 1-(5-methyltetrazol-2-yl)propan-2-ol?
The canonical SMILES for 1-(5-methyltetrazol-2-yl)propan-2-ol is Cc1nnn(CC(C)O)n1.
What is the InChIKey of 1-(5-methyltetrazol-2-yl)propan-2-ol?
The InChIKey is WYEPTLRGOWQDPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N4O/c1-4(10)3-9-7-5(2)6-8-9/h4,10H,3H2,1-2H3.
What are the key properties of 1-(5-methyltetrazol-2-yl)propan-2-ol?
1-(5-methyltetrazol-2-yl)propan-2-ol has a molecular weight of 142.16 g/mol, XLogP of -0.64, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-methyltetrazol-2-yl)propan-2-ol is sourced from PubChem (CID 13290938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).