N-[2-(4-methylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine

C10H18N4S — CID 60701896

IUPACN-[2-(4-methylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine
SMILESCN1CCN(CCNc2nccs2)CC1
InChIInChI=1S/C10H18N4S/c1-13-5-7-14(8-6-13)4-2-11-10-12-3-9-15-10/h3,9H,2,4-8H2,1H3,(H,11,12)
InChIKeyOSVRANZVSRWVRV-UHFFFAOYSA-N
MW226.35 g/mol
LogP0.80
Rot. Bonds4

About N-[2-(4-methylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine

N-[2-(4-methylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine (PubChem CID 60701896) has the molecular formula C10H18N4S and a molecular weight of 226.35 g/mol. Its IUPAC name is N-[2-(4-methylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-[2-(4-methylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine
PubChem CID60701896
Molecular FormulaC10H18N4S
Molecular Weight226.35 g/mol
Exact Mass226.13
IUPAC NameN-[2-(4-methylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine
SMILESCN1CCN(CCNc2nccs2)CC1
InChIInChI=1S/C10H18N4S/c1-13-5-7-14(8-6-13)4-2-11-10-12-3-9-15-10/h3,9H,2,4-8H2,1H3,(H,11,12)
InChIKeyOSVRANZVSRWVRV-UHFFFAOYSA-N
XLogP0.80
TPSA31.40 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.35
LogP ≤ 50.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-pyrrolidin-1-ylethyl)-1,3-thiazol-2-amine
CID 60659943
N-(2-piperazin-1-ylethyl)-1,3-thiazol-2-amine
CID 43600406
2-N-[2-(4-methylpiperazin-1-yl)ethyl]-1,3-thiazole-2,5-diamine
CID 102767758
N-[2-(4-methylpiperazin-1-yl)ethyl]-1-(1,3-thiazol-2-yl)ethanamine
CID 64993645
N-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-1,3-thiazol-2-amine
CID 89427881
N-[2-(4-methylpiperazin-1-yl)ethyl]thieno[2,3-d]pyrimidin-4-amine
CID 60702109
2-(1,3-thiazol-2-ylamino)ethanethiol
CID 88739405
CID 59694819
CID 59694819
N-(2-pyrrolidin-1-ylethyl)-N'-(1,3-thiazol-2-yl)oxamide
CID 88759235
N'-propan-2-yl-N-(1,3-thiazol-2-yl)ethane-1,2-diamine
CID 20786153
3-tert-butyl-N-[2-(4-methylpiperazin-1-yl)ethyl]-1,2,4-thiadiazol-5-amine
CID 65271410
N-[2-(4-bromopyrazol-1-yl)ethyl]-1,3-thiazol-2-amine
CID 130563769

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-methylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine?
The IUPAC name of N-[2-(4-methylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine (CID 60701896) is N-[2-(4-methylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine.
What is the SMILES notation for N-[2-(4-methylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine?
The canonical SMILES for N-[2-(4-methylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine is CN1CCN(CCNc2nccs2)CC1.
What is the InChIKey of N-[2-(4-methylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine?
The InChIKey is OSVRANZVSRWVRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4S/c1-13-5-7-14(8-6-13)4-2-11-10-12-3-9-15-10/h3,9H,2,4-8H2,1H3,(H,11,12).
What are the key properties of N-[2-(4-methylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine?
N-[2-(4-methylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine has a molecular weight of 226.35 g/mol, XLogP of 0.80, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-methylpiperazin-1-yl)ethyl]-1,3-thiazol-2-amine is sourced from PubChem (CID 60701896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).