[1-[(1-methyltetrazol-5-yl)amino]cyclohexyl]methanol

C9H17N5O — CID 63149894

IUPAC[1-[(1-methyltetrazol-5-yl)amino]cyclohexyl]methanol
SMILESCn1nnnc1NC1(CO)CCCCC1
InChIInChI=1S/C9H17N5O/c1-14-8(11-12-13-14)10-9(7-15)5-3-2-4-6-9/h15H,2-7H2,1H3,(H,10,11,13)
InChIKeyHDYAHBRXSNOVFF-UHFFFAOYSA-N
MW211.27 g/mol
LogP0.32
Rot. Bonds3

About [1-[(1-methyltetrazol-5-yl)amino]cyclohexyl]methanol

[1-[(1-methyltetrazol-5-yl)amino]cyclohexyl]methanol (PubChem CID 63149894) has the molecular formula C9H17N5O and a molecular weight of 211.27 g/mol. Its IUPAC name is [1-[(1-methyltetrazol-5-yl)amino]cyclohexyl]methanol.

Molecular Properties

Compound Name[1-[(1-methyltetrazol-5-yl)amino]cyclohexyl]methanol
PubChem CID63149894
Molecular FormulaC9H17N5O
Molecular Weight211.27 g/mol
Exact Mass211.14
IUPAC Name[1-[(1-methyltetrazol-5-yl)amino]cyclohexyl]methanol
SMILESCn1nnnc1NC1(CO)CCCCC1
InChIInChI=1S/C9H17N5O/c1-14-8(11-12-13-14)10-9(7-15)5-3-2-4-6-9/h15H,2-7H2,1H3,(H,10,11,13)
InChIKeyHDYAHBRXSNOVFF-UHFFFAOYSA-N
XLogP0.32
TPSA75.86 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.27
LogP ≤ 50.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [1-[(1-methyltetrazol-5-yl)amino]cyclohexyl]methanol?
The IUPAC name of [1-[(1-methyltetrazol-5-yl)amino]cyclohexyl]methanol (CID 63149894) is [1-[(1-methyltetrazol-5-yl)amino]cyclohexyl]methanol.
What is the SMILES notation for [1-[(1-methyltetrazol-5-yl)amino]cyclohexyl]methanol?
The canonical SMILES for [1-[(1-methyltetrazol-5-yl)amino]cyclohexyl]methanol is Cn1nnnc1NC1(CO)CCCCC1.
What is the InChIKey of [1-[(1-methyltetrazol-5-yl)amino]cyclohexyl]methanol?
The InChIKey is HDYAHBRXSNOVFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N5O/c1-14-8(11-12-13-14)10-9(7-15)5-3-2-4-6-9/h15H,2-7H2,1H3,(H,10,11,13).
What are the key properties of [1-[(1-methyltetrazol-5-yl)amino]cyclohexyl]methanol?
[1-[(1-methyltetrazol-5-yl)amino]cyclohexyl]methanol has a molecular weight of 211.27 g/mol, XLogP of 0.32, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(1-methyltetrazol-5-yl)amino]cyclohexyl]methanol is sourced from PubChem (CID 63149894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).