4-(1-aminoethyl)-N-cyclopropyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-2-amine

C10H14F3N3S — CID 64543144

IUPAC4-(1-aminoethyl)-N-cyclopropyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-2-amine
SMILESCC(N)c1csc(N(CC(F)(F)F)C2CC2)n1
InChIInChI=1S/C10H14F3N3S/c1-6(14)8-4-17-9(15-8)16(7-2-3-7)5-10(11,12)13/h4,6-7H,2-3,5,14H2,1H3
InChIKeySXCXTOJVDKZUKC-UHFFFAOYSA-N
MW265.30 g/mol
LogP2.69
Rot. Bonds4

About 4-(1-aminoethyl)-N-cyclopropyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-2-amine

4-(1-aminoethyl)-N-cyclopropyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-2-amine (PubChem CID 64543144) has the molecular formula C10H14F3N3S and a molecular weight of 265.30 g/mol. Its IUPAC name is 4-(1-aminoethyl)-N-cyclopropyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-(1-aminoethyl)-N-cyclopropyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-2-amine
PubChem CID64543144
Molecular FormulaC10H14F3N3S
Molecular Weight265.30 g/mol
Exact Mass265.09
IUPAC Name4-(1-aminoethyl)-N-cyclopropyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-2-amine
SMILESCC(N)c1csc(N(CC(F)(F)F)C2CC2)n1
InChIInChI=1S/C10H14F3N3S/c1-6(14)8-4-17-9(15-8)16(7-2-3-7)5-10(11,12)13/h4,6-7H,2-3,5,14H2,1H3
InChIKeySXCXTOJVDKZUKC-UHFFFAOYSA-N
XLogP2.69
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.30
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(1-aminoethyl)-N-cyclopropyl-N-ethyl-1,3-thiazol-2-amine
CID 64543335
4-(1-aminoethyl)-N-cyclohexyl-N-ethyl-1,3-thiazol-2-amine
CID 64544532
N-cyclopropyl-4-[1-(ethylamino)ethyl]-N-(2-methylpropyl)-1,3-thiazol-2-amine
CID 64543352
1-[2-(2-fluoropropan-2-yl)-1,3-thiazol-4-yl]ethanamine
CID 84770829
N-cyclopropyl-N-methyl-4-propan-2-yl-1,3-thiazol-2-amine
CID 130693733
1-[2-(1,1-difluoroethyl)-1,3-thiazol-4-yl]ethanamine
CID 84772376
N-butyl-N-cyclopropyl-4-[1-(ethylamino)ethyl]-1,3-thiazol-2-amine
CID 64544356
N-cyclohexyl-N-ethyl-4-[1-(propylamino)ethyl]-1,3-thiazol-2-amine
CID 64544326
4-(1-aminoethyl)-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-1,3-thiazol-2-amine
CID 64545176
2-[(1S)-1-aminoethyl]-N-cyclopropyl-3-fluoro-N-(2,2,2-trifluoroethyl)aniline
CID 55189954
5-(aminomethyl)-4-tert-butyl-N-cyclopropyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-2-amine
CID 62768020
4-(1-aminoethyl)-N-pentyl-N-propan-2-yl-1,3-thiazol-2-amine
CID 64544162

Frequently Asked Questions

What is the IUPAC name of 4-(1-aminoethyl)-N-cyclopropyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-2-amine?
The IUPAC name of 4-(1-aminoethyl)-N-cyclopropyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-2-amine (CID 64543144) is 4-(1-aminoethyl)-N-cyclopropyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4-(1-aminoethyl)-N-cyclopropyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-2-amine?
The canonical SMILES for 4-(1-aminoethyl)-N-cyclopropyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-2-amine is CC(N)c1csc(N(CC(F)(F)F)C2CC2)n1.
What is the InChIKey of 4-(1-aminoethyl)-N-cyclopropyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-2-amine?
The InChIKey is SXCXTOJVDKZUKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14F3N3S/c1-6(14)8-4-17-9(15-8)16(7-2-3-7)5-10(11,12)13/h4,6-7H,2-3,5,14H2,1H3.
What are the key properties of 4-(1-aminoethyl)-N-cyclopropyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-2-amine?
4-(1-aminoethyl)-N-cyclopropyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-2-amine has a molecular weight of 265.30 g/mol, XLogP of 2.69, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-aminoethyl)-N-cyclopropyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 64543144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).