1-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-1-ol

C8H14N4O — CID 107052346

IUPAC1-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-1-ol
SMILESCn1nnc(CCC(O)C2CC2)n1
InChIInChI=1S/C8H14N4O/c1-12-10-8(9-11-12)5-4-7(13)6-2-3-6/h6-7,13H,2-5H2,1H3
InChIKeyWMYOTUXZKCYHNV-UHFFFAOYSA-N
MW182.23 g/mol
LogP-0.09
Rot. Bonds4

About 1-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-1-ol

1-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-1-ol (PubChem CID 107052346) has the molecular formula C8H14N4O and a molecular weight of 182.23 g/mol. Its IUPAC name is 1-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-1-ol.

Molecular Properties

Compound Name1-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-1-ol
PubChem CID107052346
Molecular FormulaC8H14N4O
Molecular Weight182.23 g/mol
Exact Mass182.12
IUPAC Name1-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-1-ol
SMILESCn1nnc(CCC(O)C2CC2)n1
InChIInChI=1S/C8H14N4O/c1-12-10-8(9-11-12)5-4-7(13)6-2-3-6/h6-7,13H,2-5H2,1H3
InChIKeyWMYOTUXZKCYHNV-UHFFFAOYSA-N
XLogP-0.09
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.23
LogP ≤ 5-0.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(3-methylcyclopentyl)-2-(2-methyltetrazol-5-yl)ethanol
CID 107047864
1-(4-ethylcyclohexyl)-2-(2-methyltetrazol-5-yl)ethanol
CID 107047858
1-(4-tert-butylcyclohexyl)-2-(2-methyltetrazol-5-yl)ethanol
CID 107046399
1-cyclopentyl-3-(2-methyltetrazol-5-yl)propan-1-amine
CID 107044748
2-(2-methyltetrazol-5-yl)-1-[(3S)-pyrrolidin-3-yl]ethanol
CID 164653633
1-cyclopentyl-N-ethyl-3-(2-methyltetrazol-5-yl)propan-1-amine
CID 107044752
1-[1-[(2-methyltetrazol-5-yl)methyl]piperidin-4-yl]ethanol
CID 107052605
1-cyclopropyl-3-pyrimidin-2-ylpropan-1-ol
CID 79436464
2-cyclopropyl-2-[(2-methyltetrazol-5-yl)methylamino]acetic acid
CID 107044903
N,2-dimethyl-4-(2-methyltetrazol-5-yl)butan-1-amine
CID 107054920
N,4-dimethyl-1-(2-methyltetrazol-5-yl)pentan-3-amine
CID 107044605
1-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-2-amine
CID 107050394

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-1-ol?
The IUPAC name of 1-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-1-ol (CID 107052346) is 1-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-1-ol.
What is the SMILES notation for 1-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-1-ol?
The canonical SMILES for 1-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-1-ol is Cn1nnc(CCC(O)C2CC2)n1.
What is the InChIKey of 1-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-1-ol?
The InChIKey is WMYOTUXZKCYHNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4O/c1-12-10-8(9-11-12)5-4-7(13)6-2-3-6/h6-7,13H,2-5H2,1H3.
What are the key properties of 1-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-1-ol?
1-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-1-ol has a molecular weight of 182.23 g/mol, XLogP of -0.09, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-3-(2-methyltetrazol-5-yl)propan-1-ol is sourced from PubChem (CID 107052346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).