1-[[(2-methyltetrazol-5-yl)methylamino]methyl]cyclopentan-1-ol

C9H17N5O — CID 107042475

IUPAC1-[[(2-methyltetrazol-5-yl)methylamino]methyl]cyclopentan-1-ol
SMILESCn1nnc(CNCC2(O)CCCC2)n1
InChIInChI=1S/C9H17N5O/c1-14-12-8(11-13-14)6-10-7-9(15)4-2-3-5-9/h10,15H,2-7H2,1H3
InChIKeyCEJZNHJZDIDQHC-UHFFFAOYSA-N
MW211.27 g/mol
LogP-0.40
Rot. Bonds4

About 1-[[(2-methyltetrazol-5-yl)methylamino]methyl]cyclopentan-1-ol

1-[[(2-methyltetrazol-5-yl)methylamino]methyl]cyclopentan-1-ol (PubChem CID 107042475) has the molecular formula C9H17N5O and a molecular weight of 211.27 g/mol. Its IUPAC name is 1-[[(2-methyltetrazol-5-yl)methylamino]methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[[(2-methyltetrazol-5-yl)methylamino]methyl]cyclopentan-1-ol
PubChem CID107042475
Molecular FormulaC9H17N5O
Molecular Weight211.27 g/mol
Exact Mass211.14
IUPAC Name1-[[(2-methyltetrazol-5-yl)methylamino]methyl]cyclopentan-1-ol
SMILESCn1nnc(CNCC2(O)CCCC2)n1
InChIInChI=1S/C9H17N5O/c1-14-12-8(11-13-14)6-10-7-9(15)4-2-3-5-9/h10,15H,2-7H2,1H3
InChIKeyCEJZNHJZDIDQHC-UHFFFAOYSA-N
XLogP-0.40
TPSA75.86 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.27
LogP ≤ 5-0.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-[[(2-methyltetrazol-5-yl)methylamino]methyl]cyclopentan-1-ol?
The IUPAC name of 1-[[(2-methyltetrazol-5-yl)methylamino]methyl]cyclopentan-1-ol (CID 107042475) is 1-[[(2-methyltetrazol-5-yl)methylamino]methyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[[(2-methyltetrazol-5-yl)methylamino]methyl]cyclopentan-1-ol?
The canonical SMILES for 1-[[(2-methyltetrazol-5-yl)methylamino]methyl]cyclopentan-1-ol is Cn1nnc(CNCC2(O)CCCC2)n1.
What is the InChIKey of 1-[[(2-methyltetrazol-5-yl)methylamino]methyl]cyclopentan-1-ol?
The InChIKey is CEJZNHJZDIDQHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N5O/c1-14-12-8(11-13-14)6-10-7-9(15)4-2-3-5-9/h10,15H,2-7H2,1H3.
What are the key properties of 1-[[(2-methyltetrazol-5-yl)methylamino]methyl]cyclopentan-1-ol?
1-[[(2-methyltetrazol-5-yl)methylamino]methyl]cyclopentan-1-ol has a molecular weight of 211.27 g/mol, XLogP of -0.40, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[(2-methyltetrazol-5-yl)methylamino]methyl]cyclopentan-1-ol is sourced from PubChem (CID 107042475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).