3-[[(2-methyltetrazol-5-yl)methylamino]methyl]hexan-1-ol

C10H21N5O — CID 106115193

IUPAC3-[[(2-methyltetrazol-5-yl)methylamino]methyl]hexan-1-ol
SMILESCCCC(CCO)CNCc1nnn(C)n1
InChIInChI=1S/C10H21N5O/c1-3-4-9(5-6-16)7-11-8-10-12-14-15(2)13-10/h9,11,16H,3-8H2,1-2H3
InChIKeyLSDLNFSMLYTQDU-UHFFFAOYSA-N
MW227.31 g/mol
LogP0.10
Rot. Bonds8

About 3-[[(2-methyltetrazol-5-yl)methylamino]methyl]hexan-1-ol

3-[[(2-methyltetrazol-5-yl)methylamino]methyl]hexan-1-ol (PubChem CID 106115193) has the molecular formula C10H21N5O and a molecular weight of 227.31 g/mol. Its IUPAC name is 3-[[(2-methyltetrazol-5-yl)methylamino]methyl]hexan-1-ol.

Molecular Properties

Compound Name3-[[(2-methyltetrazol-5-yl)methylamino]methyl]hexan-1-ol
PubChem CID106115193
Molecular FormulaC10H21N5O
Molecular Weight227.31 g/mol
Exact Mass227.17
IUPAC Name3-[[(2-methyltetrazol-5-yl)methylamino]methyl]hexan-1-ol
SMILESCCCC(CCO)CNCc1nnn(C)n1
InChIInChI=1S/C10H21N5O/c1-3-4-9(5-6-16)7-11-8-10-12-14-15(2)13-10/h9,11,16H,3-8H2,1-2H3
InChIKeyLSDLNFSMLYTQDU-UHFFFAOYSA-N
XLogP0.10
TPSA75.86 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 50.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 3-[[(2-methyltetrazol-5-yl)methylamino]methyl]hexan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-[[(2-methyltetrazol-5-yl)methylamino]methyl]hexan-1-ol?
The IUPAC name of 3-[[(2-methyltetrazol-5-yl)methylamino]methyl]hexan-1-ol (CID 106115193) is 3-[[(2-methyltetrazol-5-yl)methylamino]methyl]hexan-1-ol.
What is the SMILES notation for 3-[[(2-methyltetrazol-5-yl)methylamino]methyl]hexan-1-ol?
The canonical SMILES for 3-[[(2-methyltetrazol-5-yl)methylamino]methyl]hexan-1-ol is CCCC(CCO)CNCc1nnn(C)n1.
What is the InChIKey of 3-[[(2-methyltetrazol-5-yl)methylamino]methyl]hexan-1-ol?
The InChIKey is LSDLNFSMLYTQDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N5O/c1-3-4-9(5-6-16)7-11-8-10-12-14-15(2)13-10/h9,11,16H,3-8H2,1-2H3.
What are the key properties of 3-[[(2-methyltetrazol-5-yl)methylamino]methyl]hexan-1-ol?
3-[[(2-methyltetrazol-5-yl)methylamino]methyl]hexan-1-ol has a molecular weight of 227.31 g/mol, XLogP of 0.10, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[(2-methyltetrazol-5-yl)methylamino]methyl]hexan-1-ol is sourced from PubChem (CID 106115193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).