1-[(1-cyclohexyltetrazol-5-yl)methyl]-4-methylpiperidine

C14H25N5 — CID 858597

IUPAC1-[(1-cyclohexyltetrazol-5-yl)methyl]-4-methylpiperidine
SMILESCC1CCN(Cc2nnnn2C2CCCCC2)CC1
InChIInChI=1S/C14H25N5/c1-12-7-9-18(10-8-12)11-14-15-16-17-19(14)13-5-3-2-4-6-13/h12-13H,2-11H2,1H3
InChIKeyPGFVJNLDNBEDLS-UHFFFAOYSA-N
MW263.39 g/mol
LogP2.41
Rot. Bonds3

About 1-[(1-cyclohexyltetrazol-5-yl)methyl]-4-methylpiperidine

1-[(1-cyclohexyltetrazol-5-yl)methyl]-4-methylpiperidine (PubChem CID 858597) has the molecular formula C14H25N5 and a molecular weight of 263.39 g/mol. Its IUPAC name is 1-[(1-cyclohexyltetrazol-5-yl)methyl]-4-methylpiperidine.

Molecular Properties

Compound Name1-[(1-cyclohexyltetrazol-5-yl)methyl]-4-methylpiperidine
PubChem CID858597
Molecular FormulaC14H25N5
Molecular Weight263.39 g/mol
Exact Mass263.21
IUPAC Name1-[(1-cyclohexyltetrazol-5-yl)methyl]-4-methylpiperidine
SMILESCC1CCN(Cc2nnnn2C2CCCCC2)CC1
InChIInChI=1S/C14H25N5/c1-12-7-9-18(10-8-12)11-14-15-16-17-19(14)13-5-3-2-4-6-13/h12-13H,2-11H2,1H3
InChIKeyPGFVJNLDNBEDLS-UHFFFAOYSA-N
XLogP2.41
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.39
LogP ≤ 52.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 1-[(1-cyclohexyltetrazol-5-yl)methyl]-4-methylpiperidine 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 1-[(1-cyclohexyltetrazol-5-yl)methyl]-4-methylpiperidine?
The IUPAC name of 1-[(1-cyclohexyltetrazol-5-yl)methyl]-4-methylpiperidine (CID 858597) is 1-[(1-cyclohexyltetrazol-5-yl)methyl]-4-methylpiperidine.
What is the SMILES notation for 1-[(1-cyclohexyltetrazol-5-yl)methyl]-4-methylpiperidine?
The canonical SMILES for 1-[(1-cyclohexyltetrazol-5-yl)methyl]-4-methylpiperidine is CC1CCN(Cc2nnnn2C2CCCCC2)CC1.
What is the InChIKey of 1-[(1-cyclohexyltetrazol-5-yl)methyl]-4-methylpiperidine?
The InChIKey is PGFVJNLDNBEDLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N5/c1-12-7-9-18(10-8-12)11-14-15-16-17-19(14)13-5-3-2-4-6-13/h12-13H,2-11H2,1H3.
What are the key properties of 1-[(1-cyclohexyltetrazol-5-yl)methyl]-4-methylpiperidine?
1-[(1-cyclohexyltetrazol-5-yl)methyl]-4-methylpiperidine has a molecular weight of 263.39 g/mol, XLogP of 2.41, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1-cyclohexyltetrazol-5-yl)methyl]-4-methylpiperidine is sourced from PubChem (CID 858597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).