N'-cyclopentyl-N'-(1,3-dimethylpyrazolo[5,4-d][1,3]thiazol-5-yl)-N,N-dimethylethane-1,2-diamine

C15H25N5S — CID 72923328

IUPACN'-cyclopentyl-N'-(1,3-dimethylpyrazolo[5,4-d][1,3]thiazol-5-yl)-N,N-dimethylethane-1,2-diamine
SMILESCc1nn(C)c2nc(N(CCN(C)C)C3CCCC3)sc12
InChIInChI=1S/C15H25N5S/c1-11-13-14(19(4)17-11)16-15(21-13)20(10-9-18(2)3)12-7-5-6-8-12/h12H,5-10H2,1-4H3
InChIKeyVGHMIFIUHIYVPI-UHFFFAOYSA-N
MW307.47 g/mol
LogP2.65
Rot. Bonds5

About N'-cyclopentyl-N'-(1,3-dimethylpyrazolo[5,4-d][1,3]thiazol-5-yl)-N,N-dimethylethane-1,2-diamine

N'-cyclopentyl-N'-(1,3-dimethylpyrazolo[5,4-d][1,3]thiazol-5-yl)-N,N-dimethylethane-1,2-diamine (PubChem CID 72923328) has the molecular formula C15H25N5S and a molecular weight of 307.47 g/mol. Its IUPAC name is N'-cyclopentyl-N'-(1,3-dimethylpyrazolo[5,4-d][1,3]thiazol-5-yl)-N,N-dimethylethane-1,2-diamine.

Molecular Properties

Compound NameN'-cyclopentyl-N'-(1,3-dimethylpyrazolo[5,4-d][1,3]thiazol-5-yl)-N,N-dimethylethane-1,2-diamine
PubChem CID72923328
Molecular FormulaC15H25N5S
Molecular Weight307.47 g/mol
Exact Mass307.18
IUPAC NameN'-cyclopentyl-N'-(1,3-dimethylpyrazolo[5,4-d][1,3]thiazol-5-yl)-N,N-dimethylethane-1,2-diamine
SMILESCc1nn(C)c2nc(N(CCN(C)C)C3CCCC3)sc12
InChIInChI=1S/C15H25N5S/c1-11-13-14(19(4)17-11)16-15(21-13)20(10-9-18(2)3)12-7-5-6-8-12/h12H,5-10H2,1-4H3
InChIKeyVGHMIFIUHIYVPI-UHFFFAOYSA-N
XLogP2.65
TPSA37.19 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.47
LogP ≤ 52.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N'-cyclopentyl-N'-(1,3-dimethylpyrazolo[5,4-d][1,3]thiazol-5-yl)-N,N-dimethylethane-1,2-diamine?
The IUPAC name of N'-cyclopentyl-N'-(1,3-dimethylpyrazolo[5,4-d][1,3]thiazol-5-yl)-N,N-dimethylethane-1,2-diamine (CID 72923328) is N'-cyclopentyl-N'-(1,3-dimethylpyrazolo[5,4-d][1,3]thiazol-5-yl)-N,N-dimethylethane-1,2-diamine.
What is the SMILES notation for N'-cyclopentyl-N'-(1,3-dimethylpyrazolo[5,4-d][1,3]thiazol-5-yl)-N,N-dimethylethane-1,2-diamine?
The canonical SMILES for N'-cyclopentyl-N'-(1,3-dimethylpyrazolo[5,4-d][1,3]thiazol-5-yl)-N,N-dimethylethane-1,2-diamine is Cc1nn(C)c2nc(N(CCN(C)C)C3CCCC3)sc12.
What is the InChIKey of N'-cyclopentyl-N'-(1,3-dimethylpyrazolo[5,4-d][1,3]thiazol-5-yl)-N,N-dimethylethane-1,2-diamine?
The InChIKey is VGHMIFIUHIYVPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5S/c1-11-13-14(19(4)17-11)16-15(21-13)20(10-9-18(2)3)12-7-5-6-8-12/h12H,5-10H2,1-4H3.
What are the key properties of N'-cyclopentyl-N'-(1,3-dimethylpyrazolo[5,4-d][1,3]thiazol-5-yl)-N,N-dimethylethane-1,2-diamine?
N'-cyclopentyl-N'-(1,3-dimethylpyrazolo[5,4-d][1,3]thiazol-5-yl)-N,N-dimethylethane-1,2-diamine has a molecular weight of 307.47 g/mol, XLogP of 2.65, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclopentyl-N'-(1,3-dimethylpyrazolo[5,4-d][1,3]thiazol-5-yl)-N,N-dimethylethane-1,2-diamine is sourced from PubChem (CID 72923328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).