1,5-dimethyl-N-(1-thiophen-2-ylethyl)pyrazol-3-amine

C11H15N3S — CID 115922060

IUPAC1,5-dimethyl-N-(1-thiophen-2-ylethyl)pyrazol-3-amine
SMILESCc1cc(NC(C)c2cccs2)nn1C
InChIInChI=1S/C11H15N3S/c1-8-7-11(13-14(8)3)12-9(2)10-5-4-6-15-10/h4-7,9H,1-3H3,(H,12,13)
InChIKeyKZORYVRHPAJKJN-UHFFFAOYSA-N
MW221.33 g/mol
LogP2.96
Rot. Bonds3

About 1,5-dimethyl-N-(1-thiophen-2-ylethyl)pyrazol-3-amine

1,5-dimethyl-N-(1-thiophen-2-ylethyl)pyrazol-3-amine (PubChem CID 115922060) has the molecular formula C11H15N3S and a molecular weight of 221.33 g/mol. Its IUPAC name is 1,5-dimethyl-N-(1-thiophen-2-ylethyl)pyrazol-3-amine.

Molecular Properties

Compound Name1,5-dimethyl-N-(1-thiophen-2-ylethyl)pyrazol-3-amine
PubChem CID115922060
Molecular FormulaC11H15N3S
Molecular Weight221.33 g/mol
Exact Mass221.10
IUPAC Name1,5-dimethyl-N-(1-thiophen-2-ylethyl)pyrazol-3-amine
SMILESCc1cc(NC(C)c2cccs2)nn1C
InChIInChI=1S/C11H15N3S/c1-8-7-11(13-14(8)3)12-9(2)10-5-4-6-15-10/h4-7,9H,1-3H3,(H,12,13)
InChIKeyKZORYVRHPAJKJN-UHFFFAOYSA-N
XLogP2.96
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 ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1,5-dimethyl-N-[1-(1,3-thiazol-5-yl)ethyl]pyrazol-3-amine
CID 115922073
1,5-dimethyl-N-[1-(5-methylfuran-2-yl)ethyl]pyrazol-3-amine
CID 115922058
(1R)-N-[(2,5-dimethylpyrazol-3-yl)methyl]-1-thiophen-2-ylethanamine
CID 81408199
6-chloro-2-propyl-N-(1-thiophen-2-ylethyl)pyrimidin-4-amine
CID 80940733
2-ethyl-6-N-methyl-4-N-(1-thiophen-2-ylethyl)pyrimidine-4,6-diamine
CID 80933955
2-[(1,5-dimethylpyrazol-3-yl)amino]propan-1-ol
CID 130502735
6-bromo-N-(1-thiophen-2-ylethyl)pyridin-2-amine
CID 63961100
3-(4-methyl-1,2,4-triazol-3-yl)-N-(1-thiophen-2-ylethyl)aniline
CID 43738674
N-(1-thiophen-2-ylethyl)pyrimidin-2-amine
CID 43397770
1,5-dimethyl-3-thiophen-2-ylpyrazole
CID 59635615
4-(4-methyl-1,2,4-triazol-3-yl)-N-(1-thiophen-2-ylethyl)aniline
CID 43686655
3-ethyl-1-methyl-5-N-(1-thiophen-2-ylethyl)pyrazole-4,5-diamine
CID 66015588

Frequently Asked Questions

What is the IUPAC name of 1,5-dimethyl-N-(1-thiophen-2-ylethyl)pyrazol-3-amine?
The IUPAC name of 1,5-dimethyl-N-(1-thiophen-2-ylethyl)pyrazol-3-amine (CID 115922060) is 1,5-dimethyl-N-(1-thiophen-2-ylethyl)pyrazol-3-amine.
What is the SMILES notation for 1,5-dimethyl-N-(1-thiophen-2-ylethyl)pyrazol-3-amine?
The canonical SMILES for 1,5-dimethyl-N-(1-thiophen-2-ylethyl)pyrazol-3-amine is Cc1cc(NC(C)c2cccs2)nn1C.
What is the InChIKey of 1,5-dimethyl-N-(1-thiophen-2-ylethyl)pyrazol-3-amine?
The InChIKey is KZORYVRHPAJKJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3S/c1-8-7-11(13-14(8)3)12-9(2)10-5-4-6-15-10/h4-7,9H,1-3H3,(H,12,13).
What are the key properties of 1,5-dimethyl-N-(1-thiophen-2-ylethyl)pyrazol-3-amine?
1,5-dimethyl-N-(1-thiophen-2-ylethyl)pyrazol-3-amine has a molecular weight of 221.33 g/mol, XLogP of 2.96, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethyl-N-(1-thiophen-2-ylethyl)pyrazol-3-amine is sourced from PubChem (CID 115922060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).