N-methyl-1-(1-methylpyrazol-3-yl)-1-(3-methylthiophen-2-yl)methanamine

C11H15N3S — CID 79987622

IUPACN-methyl-1-(1-methylpyrazol-3-yl)-1-(3-methylthiophen-2-yl)methanamine
SMILESCNC(c1ccn(C)n1)c1sccc1C
InChIInChI=1S/C11H15N3S/c1-8-5-7-15-11(8)10(12-2)9-4-6-14(3)13-9/h4-7,10,12H,1-3H3
InChIKeyCEFIGPAAXJYPCW-UHFFFAOYSA-N
MW221.33 g/mol
LogP2.10
Rot. Bonds3

About N-methyl-1-(1-methylpyrazol-3-yl)-1-(3-methylthiophen-2-yl)methanamine

N-methyl-1-(1-methylpyrazol-3-yl)-1-(3-methylthiophen-2-yl)methanamine (PubChem CID 79987622) has the molecular formula C11H15N3S and a molecular weight of 221.33 g/mol. Its IUPAC name is N-methyl-1-(1-methylpyrazol-3-yl)-1-(3-methylthiophen-2-yl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(1-methylpyrazol-3-yl)-1-(3-methylthiophen-2-yl)methanamine
PubChem CID79987622
Molecular FormulaC11H15N3S
Molecular Weight221.33 g/mol
Exact Mass221.10
IUPAC NameN-methyl-1-(1-methylpyrazol-3-yl)-1-(3-methylthiophen-2-yl)methanamine
SMILESCNC(c1ccn(C)n1)c1sccc1C
InChIInChI=1S/C11H15N3S/c1-8-5-7-15-11(8)10(12-2)9-4-6-14(3)13-9/h4-7,10,12H,1-3H3
InChIKeyCEFIGPAAXJYPCW-UHFFFAOYSA-N
XLogP2.10
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.33
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-methyl-1-(1-methylpyrazol-3-yl)-1-(3-methylthiophen-2-yl)methanamine 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-methyl-1-(1-methylpyrazol-3-yl)-1-(3-methylthiophen-2-yl)methanamine?
The IUPAC name of N-methyl-1-(1-methylpyrazol-3-yl)-1-(3-methylthiophen-2-yl)methanamine (CID 79987622) is N-methyl-1-(1-methylpyrazol-3-yl)-1-(3-methylthiophen-2-yl)methanamine.
What is the SMILES notation for N-methyl-1-(1-methylpyrazol-3-yl)-1-(3-methylthiophen-2-yl)methanamine?
The canonical SMILES for N-methyl-1-(1-methylpyrazol-3-yl)-1-(3-methylthiophen-2-yl)methanamine is CNC(c1ccn(C)n1)c1sccc1C.
What is the InChIKey of N-methyl-1-(1-methylpyrazol-3-yl)-1-(3-methylthiophen-2-yl)methanamine?
The InChIKey is CEFIGPAAXJYPCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3S/c1-8-5-7-15-11(8)10(12-2)9-4-6-14(3)13-9/h4-7,10,12H,1-3H3.
What are the key properties of N-methyl-1-(1-methylpyrazol-3-yl)-1-(3-methylthiophen-2-yl)methanamine?
N-methyl-1-(1-methylpyrazol-3-yl)-1-(3-methylthiophen-2-yl)methanamine has a molecular weight of 221.33 g/mol, XLogP of 2.10, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(1-methylpyrazol-3-yl)-1-(3-methylthiophen-2-yl)methanamine is sourced from PubChem (CID 79987622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).