4-methyl-1-(4-methylcycloheptyl)pyrazol-5-amine

C12H21N3 — CID 65084658

IUPAC4-methyl-1-(4-methylcycloheptyl)pyrazol-5-amine
SMILESCc1cnn(C2CCCC(C)CC2)c1N
InChIInChI=1S/C12H21N3/c1-9-4-3-5-11(7-6-9)15-12(13)10(2)8-14-15/h8-9,11H,3-7,13H2,1-2H3
InChIKeyZIGNXNVSRUQKMN-UHFFFAOYSA-N
MW207.32 g/mol
LogP2.92
Rot. Bonds1

About 4-methyl-1-(4-methylcycloheptyl)pyrazol-5-amine

4-methyl-1-(4-methylcycloheptyl)pyrazol-5-amine (PubChem CID 65084658) has the molecular formula C12H21N3 and a molecular weight of 207.32 g/mol. Its IUPAC name is 4-methyl-1-(4-methylcycloheptyl)pyrazol-5-amine.

Molecular Properties

Compound Name4-methyl-1-(4-methylcycloheptyl)pyrazol-5-amine
PubChem CID65084658
Molecular FormulaC12H21N3
Molecular Weight207.32 g/mol
Exact Mass207.17
IUPAC Name4-methyl-1-(4-methylcycloheptyl)pyrazol-5-amine
SMILESCc1cnn(C2CCCC(C)CC2)c1N
InChIInChI=1S/C12H21N3/c1-9-4-3-5-11(7-6-9)15-12(13)10(2)8-14-15/h8-9,11H,3-7,13H2,1-2H3
InChIKeyZIGNXNVSRUQKMN-UHFFFAOYSA-N
XLogP2.92
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-(4-methylcycloheptyl)pyrazol-5-amine?
The IUPAC name of 4-methyl-1-(4-methylcycloheptyl)pyrazol-5-amine (CID 65084658) is 4-methyl-1-(4-methylcycloheptyl)pyrazol-5-amine.
What is the SMILES notation for 4-methyl-1-(4-methylcycloheptyl)pyrazol-5-amine?
The canonical SMILES for 4-methyl-1-(4-methylcycloheptyl)pyrazol-5-amine is Cc1cnn(C2CCCC(C)CC2)c1N.
What is the InChIKey of 4-methyl-1-(4-methylcycloheptyl)pyrazol-5-amine?
The InChIKey is ZIGNXNVSRUQKMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3/c1-9-4-3-5-11(7-6-9)15-12(13)10(2)8-14-15/h8-9,11H,3-7,13H2,1-2H3.
What are the key properties of 4-methyl-1-(4-methylcycloheptyl)pyrazol-5-amine?
4-methyl-1-(4-methylcycloheptyl)pyrazol-5-amine has a molecular weight of 207.32 g/mol, XLogP of 2.92, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-(4-methylcycloheptyl)pyrazol-5-amine is sourced from PubChem (CID 65084658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).