3-(5-methyltetrazol-1-yl)propan-1-ol

C5H10N4O — CID 18726707

IUPAC3-(5-methyltetrazol-1-yl)propan-1-ol
SMILESCc1nnnn1CCCO
InChIInChI=1S/C5H10N4O/c1-5-6-7-8-9(5)3-2-4-10/h10H,2-4H2,1H3
InChIKeyCDRCDZFVFGNXDW-UHFFFAOYSA-N
MW142.16 g/mol
LogP-0.64
Rot. Bonds3

About 3-(5-methyltetrazol-1-yl)propan-1-ol

3-(5-methyltetrazol-1-yl)propan-1-ol (PubChem CID 18726707) has the molecular formula C5H10N4O and a molecular weight of 142.16 g/mol. Its IUPAC name is 3-(5-methyltetrazol-1-yl)propan-1-ol.

Molecular Properties

Compound Name3-(5-methyltetrazol-1-yl)propan-1-ol
PubChem CID18726707
Molecular FormulaC5H10N4O
Molecular Weight142.16 g/mol
Exact Mass142.09
IUPAC Name3-(5-methyltetrazol-1-yl)propan-1-ol
SMILESCc1nnnn1CCCO
InChIInChI=1S/C5H10N4O/c1-5-6-7-8-9(5)3-2-4-10/h10H,2-4H2,1H3
InChIKeyCDRCDZFVFGNXDW-UHFFFAOYSA-N
XLogP-0.64
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
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 3-(5-methyltetrazol-1-yl)propan-1-ol?
The IUPAC name of 3-(5-methyltetrazol-1-yl)propan-1-ol (CID 18726707) is 3-(5-methyltetrazol-1-yl)propan-1-ol.
What is the SMILES notation for 3-(5-methyltetrazol-1-yl)propan-1-ol?
The canonical SMILES for 3-(5-methyltetrazol-1-yl)propan-1-ol is Cc1nnnn1CCCO.
What is the InChIKey of 3-(5-methyltetrazol-1-yl)propan-1-ol?
The InChIKey is CDRCDZFVFGNXDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N4O/c1-5-6-7-8-9(5)3-2-4-10/h10H,2-4H2,1H3.
What are the key properties of 3-(5-methyltetrazol-1-yl)propan-1-ol?
3-(5-methyltetrazol-1-yl)propan-1-ol has a molecular weight of 142.16 g/mol, XLogP of -0.64, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-methyltetrazol-1-yl)propan-1-ol is sourced from PubChem (CID 18726707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).