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

C14H18N4S — CID 56866914

IUPAC4-cyclopentyl-N-[2-(1,3-thiazol-2-yl)ethyl]pyrimidin-2-amine
SMILESc1cc(C2CCCC2)nc(NCCc2nccs2)n1
InChIInChI=1S/C14H18N4S/c1-2-4-11(3-1)12-5-7-16-14(18-12)17-8-6-13-15-9-10-19-13/h5,7,9-11H,1-4,6,8H2,(H,16,17,18)
InChIKeyWMWCATNDZGBFJA-UHFFFAOYSA-N
MW274.39 g/mol
LogP3.25
Rot. Bonds5

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

4-cyclopentyl-N-[2-(1,3-thiazol-2-yl)ethyl]pyrimidin-2-amine (PubChem CID 56866914) has the molecular formula C14H18N4S and a molecular weight of 274.39 g/mol. Its IUPAC name is 4-cyclopentyl-N-[2-(1,3-thiazol-2-yl)ethyl]pyrimidin-2-amine.

Molecular Properties

Compound Name4-cyclopentyl-N-[2-(1,3-thiazol-2-yl)ethyl]pyrimidin-2-amine
PubChem CID56866914
Molecular FormulaC14H18N4S
Molecular Weight274.39 g/mol
Exact Mass274.13
IUPAC Name4-cyclopentyl-N-[2-(1,3-thiazol-2-yl)ethyl]pyrimidin-2-amine
SMILESc1cc(C2CCCC2)nc(NCCc2nccs2)n1
InChIInChI=1S/C14H18N4S/c1-2-4-11(3-1)12-5-7-16-14(18-12)17-8-6-13-15-9-10-19-13/h5,7,9-11H,1-4,6,8H2,(H,16,17,18)
InChIKeyWMWCATNDZGBFJA-UHFFFAOYSA-N
XLogP3.25
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.39
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclopropyl-4-(1-(2-(thiazol-4-yl)ethyl)piperidin-3-yl)pyrimidin-2-amine
CID 44591284
4-(1-amino-3-methylbutyl)-N-pyrimidin-2-yl-1,3-thiazol-2-amine
CID 49786650
4-[amino(cyclohexyl)methyl]-N-[4-(trifluoromethyl)pyrimidin-2-yl]-1,3-thiazol-2-amine
CID 49789622
4-[amino(cyclohexyl)methyl]-N-pyrimidin-2-yl-1,3-thiazol-2-amine
CID 49792548
N-[(2-Isopropyl-1,3-thiazol-4-YL)methyl]-4-(3,3,3-trifluoropropyl)pyrimidin-2-amine
CID 56864914
7-(cyclopentylmethyl)-4-N-(1,3-thiazol-2-ylmethyl)-5,6,8,9-tetrahydropyrimido[4,5-d]azepine-2,4-diamine
CID 56909323
N-[(2-Amino-1,3-thiazol-4-YL)methyl]-4-(3,3,3-trifluoropropyl)pyrimidin-2-amine
CID 56865350
7-(cyclopropylmethyl)-2-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]-6,7,8,9-tetrahydro-5H-pyrimido[4,5-d]azepin-4-amine
CID 56882870
5-methyl-N-(2-methyl-6-pyrrolidin-2-ylpyrimidin-4-yl)-1,3-thiazol-2-amine
CID 66509348
6-propan-2-yl-4-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]pyrimidine-2,4-diamine
CID 72882505
N-(2-methyl-6-pyrrolidin-2-ylpyrimidin-4-yl)-1,3-thiazol-2-amine
CID 73439470
N-[2-methyl-6-(1-propan-2-ylazetidin-3-yl)pyrimidin-4-yl]-1,3-thiazol-2-amine
CID 95842476

Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyl-N-[2-(1,3-thiazol-2-yl)ethyl]pyrimidin-2-amine?
The IUPAC name of 4-cyclopentyl-N-[2-(1,3-thiazol-2-yl)ethyl]pyrimidin-2-amine (CID 56866914) is 4-cyclopentyl-N-[2-(1,3-thiazol-2-yl)ethyl]pyrimidin-2-amine.
What is the SMILES notation for 4-cyclopentyl-N-[2-(1,3-thiazol-2-yl)ethyl]pyrimidin-2-amine?
The canonical SMILES for 4-cyclopentyl-N-[2-(1,3-thiazol-2-yl)ethyl]pyrimidin-2-amine is c1cc(C2CCCC2)nc(NCCc2nccs2)n1.
What is the InChIKey of 4-cyclopentyl-N-[2-(1,3-thiazol-2-yl)ethyl]pyrimidin-2-amine?
The InChIKey is WMWCATNDZGBFJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4S/c1-2-4-11(3-1)12-5-7-16-14(18-12)17-8-6-13-15-9-10-19-13/h5,7,9-11H,1-4,6,8H2,(H,16,17,18).
What are the key properties of 4-cyclopentyl-N-[2-(1,3-thiazol-2-yl)ethyl]pyrimidin-2-amine?
4-cyclopentyl-N-[2-(1,3-thiazol-2-yl)ethyl]pyrimidin-2-amine has a molecular weight of 274.39 g/mol, XLogP of 3.25, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentyl-N-[2-(1,3-thiazol-2-yl)ethyl]pyrimidin-2-amine is sourced from PubChem (CID 56866914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).