N-[(1-methylcyclohexyl)methyl]tetrazolo[1,5-a]pyrazin-5-amine

C12H18N6 — CID 103753720

IUPACN-[(1-methylcyclohexyl)methyl]tetrazolo[1,5-a]pyrazin-5-amine
SMILESCC1(CNc2cncc3nnnn23)CCCCC1
InChIInChI=1S/C12H18N6/c1-12(5-3-2-4-6-12)9-14-10-7-13-8-11-15-16-17-18(10)11/h7-8,14H,2-6,9H2,1H3
InChIKeyZGIYLTBYNKVTBM-UHFFFAOYSA-N
MW246.32 g/mol
LogP1.90
Rot. Bonds3

About N-[(1-methylcyclohexyl)methyl]tetrazolo[1,5-a]pyrazin-5-amine

N-[(1-methylcyclohexyl)methyl]tetrazolo[1,5-a]pyrazin-5-amine (PubChem CID 103753720) has the molecular formula C12H18N6 and a molecular weight of 246.32 g/mol. Its IUPAC name is N-[(1-methylcyclohexyl)methyl]tetrazolo[1,5-a]pyrazin-5-amine.

Molecular Properties

Compound NameN-[(1-methylcyclohexyl)methyl]tetrazolo[1,5-a]pyrazin-5-amine
PubChem CID103753720
Molecular FormulaC12H18N6
Molecular Weight246.32 g/mol
Exact Mass246.16
IUPAC NameN-[(1-methylcyclohexyl)methyl]tetrazolo[1,5-a]pyrazin-5-amine
SMILESCC1(CNc2cncc3nnnn23)CCCCC1
InChIInChI=1S/C12H18N6/c1-12(5-3-2-4-6-12)9-14-10-7-13-8-11-15-16-17-18(10)11/h7-8,14H,2-6,9H2,1H3
InChIKeyZGIYLTBYNKVTBM-UHFFFAOYSA-N
XLogP1.90
TPSA68.00 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.32
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[(1-methylcyclohexyl)methyl]tetrazolo[1,5-a]pyrazin-5-amine 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 N-[(1-methylcyclohexyl)methyl]tetrazolo[1,5-a]pyrazin-5-amine?
The IUPAC name of N-[(1-methylcyclohexyl)methyl]tetrazolo[1,5-a]pyrazin-5-amine (CID 103753720) is N-[(1-methylcyclohexyl)methyl]tetrazolo[1,5-a]pyrazin-5-amine.
What is the SMILES notation for N-[(1-methylcyclohexyl)methyl]tetrazolo[1,5-a]pyrazin-5-amine?
The canonical SMILES for N-[(1-methylcyclohexyl)methyl]tetrazolo[1,5-a]pyrazin-5-amine is CC1(CNc2cncc3nnnn23)CCCCC1.
What is the InChIKey of N-[(1-methylcyclohexyl)methyl]tetrazolo[1,5-a]pyrazin-5-amine?
The InChIKey is ZGIYLTBYNKVTBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N6/c1-12(5-3-2-4-6-12)9-14-10-7-13-8-11-15-16-17-18(10)11/h7-8,14H,2-6,9H2,1H3.
What are the key properties of N-[(1-methylcyclohexyl)methyl]tetrazolo[1,5-a]pyrazin-5-amine?
N-[(1-methylcyclohexyl)methyl]tetrazolo[1,5-a]pyrazin-5-amine has a molecular weight of 246.32 g/mol, XLogP of 1.90, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-methylcyclohexyl)methyl]tetrazolo[1,5-a]pyrazin-5-amine is sourced from PubChem (CID 103753720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).