N-cyclopropyl-4-(2-methylpropyl)-4,5-dihydro-1,3-thiazol-2-amine

C10H18N2S — CID 61246522

IUPACN-cyclopropyl-4-(2-methylpropyl)-4,5-dihydro-1,3-thiazol-2-amine
SMILESCC(C)CC1CSC(NC2CC2)=N1
InChIInChI=1S/C10H18N2S/c1-7(2)5-9-6-13-10(12-9)11-8-3-4-8/h7-9H,3-6H2,1-2H3,(H,11,12)
InChIKeyOPPYUFZJWPBHPB-UHFFFAOYSA-N
MW198.33 g/mol
LogP2.26
Rot. Bonds3

About N-cyclopropyl-4-(2-methylpropyl)-4,5-dihydro-1,3-thiazol-2-amine

N-cyclopropyl-4-(2-methylpropyl)-4,5-dihydro-1,3-thiazol-2-amine (PubChem CID 61246522) has the molecular formula C10H18N2S and a molecular weight of 198.33 g/mol. Its IUPAC name is N-cyclopropyl-4-(2-methylpropyl)-4,5-dihydro-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-cyclopropyl-4-(2-methylpropyl)-4,5-dihydro-1,3-thiazol-2-amine
PubChem CID61246522
Molecular FormulaC10H18N2S
Molecular Weight198.33 g/mol
Exact Mass198.12
IUPAC NameN-cyclopropyl-4-(2-methylpropyl)-4,5-dihydro-1,3-thiazol-2-amine
SMILESCC(C)CC1CSC(NC2CC2)=N1
InChIInChI=1S/C10H18N2S/c1-7(2)5-9-6-13-10(12-9)11-8-3-4-8/h7-9H,3-6H2,1-2H3,(H,11,12)
InChIKeyOPPYUFZJWPBHPB-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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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-(2-methylpropyl)-4,5-dihydro-1,3-thiazol-2-amine?
The IUPAC name of N-cyclopropyl-4-(2-methylpropyl)-4,5-dihydro-1,3-thiazol-2-amine (CID 61246522) is N-cyclopropyl-4-(2-methylpropyl)-4,5-dihydro-1,3-thiazol-2-amine.
What is the SMILES notation for N-cyclopropyl-4-(2-methylpropyl)-4,5-dihydro-1,3-thiazol-2-amine?
The canonical SMILES for N-cyclopropyl-4-(2-methylpropyl)-4,5-dihydro-1,3-thiazol-2-amine is CC(C)CC1CSC(NC2CC2)=N1.
What is the InChIKey of N-cyclopropyl-4-(2-methylpropyl)-4,5-dihydro-1,3-thiazol-2-amine?
The InChIKey is OPPYUFZJWPBHPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2S/c1-7(2)5-9-6-13-10(12-9)11-8-3-4-8/h7-9H,3-6H2,1-2H3,(H,11,12).
What are the key properties of N-cyclopropyl-4-(2-methylpropyl)-4,5-dihydro-1,3-thiazol-2-amine?
N-cyclopropyl-4-(2-methylpropyl)-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-cyclopropyl-4-(2-methylpropyl)-4,5-dihydro-1,3-thiazol-2-amine is sourced from PubChem (CID 61246522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).