N-(1-cyclopropylethyl)-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine

C10H18N2S — CID 43533630

IUPACN-(1-cyclopropylethyl)-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine
SMILESCCC1CSC(NC(C)C2CC2)=N1
InChIInChI=1S/C10H18N2S/c1-3-9-6-13-10(12-9)11-7(2)8-4-5-8/h7-9H,3-6H2,1-2H3,(H,11,12)
InChIKeyJFHADGKCHFPOSM-UHFFFAOYSA-N
MW198.33 g/mol
LogP2.26
Rot. Bonds3

About N-(1-cyclopropylethyl)-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine

N-(1-cyclopropylethyl)-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine (PubChem CID 43533630) has the molecular formula C10H18N2S and a molecular weight of 198.33 g/mol. Its IUPAC name is N-(1-cyclopropylethyl)-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-(1-cyclopropylethyl)-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine
PubChem CID43533630
Molecular FormulaC10H18N2S
Molecular Weight198.33 g/mol
Exact Mass198.12
IUPAC NameN-(1-cyclopropylethyl)-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine
SMILESCCC1CSC(NC(C)C2CC2)=N1
InChIInChI=1S/C10H18N2S/c1-3-9-6-13-10(12-9)11-7(2)8-4-5-8/h7-9H,3-6H2,1-2H3,(H,11,12)
InChIKeyJFHADGKCHFPOSM-UHFFFAOYSA-N
XLogP2.26
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.33
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(Dicyclopropylmethylamino) thiazoline
CID 54440978
5-propan-2-yl-N-(4,4,4-trifluorobutan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine
CID 105943224
5-cyclopropyl-N-(4,4,4-trifluorobutan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine
CID 105943239
5-(2-methylpropyl)-N-(4,4,4-trifluorobutan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine
CID 105943240
4-propan-2-yl-N-(4,4,4-trifluorobutan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine
CID 105943249
4-(2-methylpropyl)-N-[1-(trifluoromethyl)cyclopropyl]-4,5-dihydro-1,3-thiazol-2-amine
CID 106219343
4-(2-methylpropyl)-N-(4,4,4-trifluorobutan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine
CID 114131552
5-pentan-3-yl-N-(4,4,4-trifluorobutan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine
CID 114168440
5-cyclopropyl-N-(5,5,5-trifluoropentyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 115520980
5-cyclopropyl-N-(2-fluoroethyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 133627688
N-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-amine
CID 29068053
N-butyl-5-cyclopropyl-4,5-dihydro-1,3-thiazol-2-amine
CID 57162043

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylethyl)-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine?
The IUPAC name of N-(1-cyclopropylethyl)-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine (CID 43533630) is N-(1-cyclopropylethyl)-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine.
What is the SMILES notation for N-(1-cyclopropylethyl)-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine?
The canonical SMILES for N-(1-cyclopropylethyl)-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine is CCC1CSC(NC(C)C2CC2)=N1.
What is the InChIKey of N-(1-cyclopropylethyl)-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine?
The InChIKey is JFHADGKCHFPOSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2S/c1-3-9-6-13-10(12-9)11-7(2)8-4-5-8/h7-9H,3-6H2,1-2H3,(H,11,12).
What are the key properties of N-(1-cyclopropylethyl)-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine?
N-(1-cyclopropylethyl)-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine has a molecular weight of 198.33 g/mol, XLogP of 2.26, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylethyl)-4-ethyl-4,5-dihydro-1,3-thiazol-2-amine is sourced from PubChem (CID 43533630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).