N-[(2-methyltetrazol-5-yl)methyl]octan-4-amine

C11H23N5 — CID 107167915

IUPACN-[(2-methyltetrazol-5-yl)methyl]octan-4-amine
SMILESCCCCC(CCC)NCc1nnn(C)n1
InChIInChI=1S/C11H23N5/c1-4-6-8-10(7-5-2)12-9-11-13-15-16(3)14-11/h10,12H,4-9H2,1-3H3
InChIKeyFZDVURKMLFDDCN-UHFFFAOYSA-N
MW225.34 g/mol
LogP1.66
Rot. Bonds8

About N-[(2-methyltetrazol-5-yl)methyl]octan-4-amine

N-[(2-methyltetrazol-5-yl)methyl]octan-4-amine (PubChem CID 107167915) has the molecular formula C11H23N5 and a molecular weight of 225.34 g/mol. Its IUPAC name is N-[(2-methyltetrazol-5-yl)methyl]octan-4-amine.

Molecular Properties

Compound NameN-[(2-methyltetrazol-5-yl)methyl]octan-4-amine
PubChem CID107167915
Molecular FormulaC11H23N5
Molecular Weight225.34 g/mol
Exact Mass225.20
IUPAC NameN-[(2-methyltetrazol-5-yl)methyl]octan-4-amine
SMILESCCCCC(CCC)NCc1nnn(C)n1
InChIInChI=1S/C11H23N5/c1-4-6-8-10(7-5-2)12-9-11-13-15-16(3)14-11/h10,12H,4-9H2,1-3H3
InChIKeyFZDVURKMLFDDCN-UHFFFAOYSA-N
XLogP1.66
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.34
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[(2-methyltetrazol-5-yl)methyl]octan-4-amine with MolForge

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

Launch Full Analysis

Related Compounds

N-methyl-6-(2-methyltetrazol-5-yl)hexan-3-amine
CID 107054892
N-[(2-methyltetrazol-5-yl)methyl]hex-5-yn-3-amine
CID 107042699
5-butyl-2-methyltetrazole;ethane
CID 144800630
4-methyl-2-[(2-methyltetrazol-5-yl)methylamino]pentan-1-ol
CID 107042235
[3-ethyl-1-(2-methyltetrazol-5-yl)heptan-2-yl]hydrazine
CID 107066910
1-(2-methyltetrazol-5-yl)octan-2-ol
CID 107046019
N-[(1-methyl-1,2,4-triazol-3-yl)methyl]undecan-6-amine
CID 103907121
3-amino-1-(2-methyltetrazol-5-yl)heptan-2-one
CID 107061843
N-[(1-methyl-3-propan-2-ylpyrazol-4-yl)methyl]octan-4-amine
CID 103781055
N-[(3-tert-butyl-1-methylpyrazol-4-yl)methyl]octan-4-amine
CID 106023294
N-[(1,2,5-trimethylpyrrol-3-yl)methyl]octan-4-amine
CID 114138041
N-[(2-methyl-1,2,4-triazol-3-yl)methyl]octan-4-amine
CID 103787498

Frequently Asked Questions

What is the IUPAC name of N-[(2-methyltetrazol-5-yl)methyl]octan-4-amine?
The IUPAC name of N-[(2-methyltetrazol-5-yl)methyl]octan-4-amine (CID 107167915) is N-[(2-methyltetrazol-5-yl)methyl]octan-4-amine.
What is the SMILES notation for N-[(2-methyltetrazol-5-yl)methyl]octan-4-amine?
The canonical SMILES for N-[(2-methyltetrazol-5-yl)methyl]octan-4-amine is CCCCC(CCC)NCc1nnn(C)n1.
What is the InChIKey of N-[(2-methyltetrazol-5-yl)methyl]octan-4-amine?
The InChIKey is FZDVURKMLFDDCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N5/c1-4-6-8-10(7-5-2)12-9-11-13-15-16(3)14-11/h10,12H,4-9H2,1-3H3.
What are the key properties of N-[(2-methyltetrazol-5-yl)methyl]octan-4-amine?
N-[(2-methyltetrazol-5-yl)methyl]octan-4-amine has a molecular weight of 225.34 g/mol, XLogP of 1.66, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methyltetrazol-5-yl)methyl]octan-4-amine is sourced from PubChem (CID 107167915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).