4-methyl-1-[(1-methylsulfanylcyclobutyl)methyl]pyrazol-5-amine

C10H17N3S — CID 130506267

IUPAC4-methyl-1-[(1-methylsulfanylcyclobutyl)methyl]pyrazol-5-amine
SMILESCSC1(Cn2ncc(C)c2N)CCC1
InChIInChI=1S/C10H17N3S/c1-8-6-12-13(9(8)11)7-10(14-2)4-3-5-10/h6H,3-5,7,11H2,1-2H3
InChIKeyUTXVLUHMWXAVHU-UHFFFAOYSA-N
MW211.33 g/mol
LogP2.06
Rot. Bonds3

About 4-methyl-1-[(1-methylsulfanylcyclobutyl)methyl]pyrazol-5-amine

4-methyl-1-[(1-methylsulfanylcyclobutyl)methyl]pyrazol-5-amine (PubChem CID 130506267) has the molecular formula C10H17N3S and a molecular weight of 211.33 g/mol. Its IUPAC name is 4-methyl-1-[(1-methylsulfanylcyclobutyl)methyl]pyrazol-5-amine.

Molecular Properties

Compound Name4-methyl-1-[(1-methylsulfanylcyclobutyl)methyl]pyrazol-5-amine
PubChem CID130506267
Molecular FormulaC10H17N3S
Molecular Weight211.33 g/mol
Exact Mass211.11
IUPAC Name4-methyl-1-[(1-methylsulfanylcyclobutyl)methyl]pyrazol-5-amine
SMILESCSC1(Cn2ncc(C)c2N)CCC1
InChIInChI=1S/C10H17N3S/c1-8-6-12-13(9(8)11)7-10(14-2)4-3-5-10/h6H,3-5,7,11H2,1-2H3
InChIKeyUTXVLUHMWXAVHU-UHFFFAOYSA-N
XLogP2.06
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.33
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-methyl-1-[(1-methylcyclobutyl)methyl]pyrazol-4-amine
CID 165480554
1-[(4,5-dimethylpyrazol-1-yl)methyl]cyclopropan-1-ol
CID 164911617
4-methyl-1-(2-methylbutyl)pyrazol-5-amine
CID 43312420
4-methyl-1-(pyrimidin-5-ylmethyl)pyrazol-5-amine
CID 130964491
4-methyl-1-(2-phenylethyl)pyrazol-5-amine
CID 43148141
4-methyl-1-[(4-phenylphenyl)methyl]pyrazol-5-amine
CID 29060877
1-[(1-methylsulfanylcyclohexyl)methyl]piperazine
CID 82510061
1-[(6-methoxy-3-pyridinyl)methyl]-4-methylpyrazol-5-amine
CID 114936958
5-bromo-N-[(1-methylsulfanylcyclobutyl)methyl]pyridin-3-amine
CID 107268827
N-[(1-methylsulfanylcyclobutyl)methyl]-1-(1-methyltriazol-4-yl)methanamine
CID 107267202
N-[(1-methylsulfanylcyclobutyl)methyl]thiadiazol-5-amine
CID 130506255
6-hydrazinyl-N-[(1-methylsulfanylcyclobutyl)methyl]pyridine-3-sulfonamide
CID 114116657

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-[(1-methylsulfanylcyclobutyl)methyl]pyrazol-5-amine?
The IUPAC name of 4-methyl-1-[(1-methylsulfanylcyclobutyl)methyl]pyrazol-5-amine (CID 130506267) is 4-methyl-1-[(1-methylsulfanylcyclobutyl)methyl]pyrazol-5-amine.
What is the SMILES notation for 4-methyl-1-[(1-methylsulfanylcyclobutyl)methyl]pyrazol-5-amine?
The canonical SMILES for 4-methyl-1-[(1-methylsulfanylcyclobutyl)methyl]pyrazol-5-amine is CSC1(Cn2ncc(C)c2N)CCC1.
What is the InChIKey of 4-methyl-1-[(1-methylsulfanylcyclobutyl)methyl]pyrazol-5-amine?
The InChIKey is UTXVLUHMWXAVHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3S/c1-8-6-12-13(9(8)11)7-10(14-2)4-3-5-10/h6H,3-5,7,11H2,1-2H3.
What are the key properties of 4-methyl-1-[(1-methylsulfanylcyclobutyl)methyl]pyrazol-5-amine?
4-methyl-1-[(1-methylsulfanylcyclobutyl)methyl]pyrazol-5-amine has a molecular weight of 211.33 g/mol, XLogP of 2.06, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-[(1-methylsulfanylcyclobutyl)methyl]pyrazol-5-amine is sourced from PubChem (CID 130506267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).