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

C15H25N5S — CID 72881792

IUPACN-cyclopentyl-N'-(1,3-dimethylpyrazolo[5,4-d][1,3]thiazol-5-yl)-N,N'-dimethylethane-1,2-diamine
SMILESCc1nn(C)c2nc(N(C)CCN(C)C3CCCC3)sc12
InChIInChI=1S/C15H25N5S/c1-11-13-14(20(4)17-11)16-15(21-13)19(3)10-9-18(2)12-7-5-6-8-12/h12H,5-10H2,1-4H3
InChIKeyRMCIFSYZNXLUPR-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 72881792) 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 CID72881792
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(C)CCN(C)C3CCCC3)sc12
InChIInChI=1S/C15H25N5S/c1-11-13-14(20(4)17-11)16-15(21-13)19(3)10-9-18(2)12-7-5-6-8-12/h12H,5-10H2,1-4H3
InChIKeyRMCIFSYZNXLUPR-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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Related Compounds

3,5-Dimethyl-7-thia-1,3,4,9,10-pentazatricyclo[6.3.0.02,6]undeca-2(6),4,8,10-tetraene
CID 15836914
1,3-dimethyl-1H,2H,5H-pyrazolo[3,4-d][1,3]thiazol-5-imine
CID 83667885
1,3-dimethyl-5-{4-[(2-methyl-1,3-thiazol-4-yl)methyl]piperazin-1-yl}-1H-pyrazolo[3,4-d][1,3]thiazole
CID 72838156
1,3-dimethyl-N-[1-(5-methyl-1H-1,2,4-triazol-3-yl)ethyl]-1H-pyrazolo[3,4-d][1,3]thiazol-5-amine
CID 72843484
N,N-bis(2-methoxyethyl)-1,3-dimethyl-1H-pyrazolo[3,4-d][1,3]thiazol-5-amine
CID 72851027
N-(1,3-dimethyl-1H-pyrazolo[3,4-d][1,3]thiazol-5-yl)-N',N'-dimethyl-N-(tetrahydrofuran-2-ylmethyl)ethane-1,2-diamine
CID 72852162
1,3-dimethyl-N-[1-(1H-tetrazol-5-yl)ethyl]-1H-pyrazolo[3,4-d][1,3]thiazol-5-amine
CID 72877630
N-[(1-isobutylpyrrolidin-3-yl)methyl]-N,1,3-trimethyl-1H-pyrazolo[3,4-d][1,3]thiazol-5-amine
CID 72883385
N-(1,3-dimethyl-1H-pyrazolo[3,4-d][1,3]thiazol-5-yl)-N,N',N'-trimethylethane-1,2-diamine
CID 72897142
N-[2-(ethylthio)ethyl]-1,3-dimethyl-1H-pyrazolo[3,4-d][1,3]thiazol-5-amine
CID 72898138
N-{[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl}-N,1,3-trimethyl-1H-pyrazolo[3,4-d][1,3]thiazol-5-amine
CID 72903384
1,3-dimethyl-N-4-piperidinyl-1H-pyrazolo[3,4-d][1,3]thiazol-5-amine dihydrochloride
CID 72919789

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 72881792) 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(C)CCN(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 RMCIFSYZNXLUPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5S/c1-11-13-14(20(4)17-11)16-15(21-13)19(3)10-9-18(2)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 72881792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).