N-cyclopropyl-5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-amine

C11H20N2S — CID 106284732

IUPACN-cyclopropyl-5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-amine
SMILESCCC(CC)C1CN=C(NC2CC2)S1
InChIInChI=1S/C11H20N2S/c1-3-8(4-2)10-7-12-11(14-10)13-9-5-6-9/h8-10H,3-7H2,1-2H3,(H,12,13)
InChIKeyZBHMNZAJLFVTMG-UHFFFAOYSA-N
MW212.36 g/mol
LogP2.65
Rot. Bonds4

About N-cyclopropyl-5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-amine

N-cyclopropyl-5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-amine (PubChem CID 106284732) has the molecular formula C11H20N2S and a molecular weight of 212.36 g/mol. Its IUPAC name is N-cyclopropyl-5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-cyclopropyl-5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-amine
PubChem CID106284732
Molecular FormulaC11H20N2S
Molecular Weight212.36 g/mol
Exact Mass212.13
IUPAC NameN-cyclopropyl-5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-amine
SMILESCCC(CC)C1CN=C(NC2CC2)S1
InChIInChI=1S/C11H20N2S/c1-3-8(4-2)10-7-12-11(14-10)13-9-5-6-9/h8-10H,3-7H2,1-2H3,(H,12,13)
InChIKeyZBHMNZAJLFVTMG-UHFFFAOYSA-N
XLogP2.65
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.36
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4,4-dimethylcyclohexyl)-5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-amine
CID 106285326
N-(2-methylcyclopropyl)-5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-amine
CID 106285186
N-(3-methylsulfanylcyclohexyl)-5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-amine
CID 106285911
N-(1-cyclopentylethyl)-5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-amine
CID 106285314
N-cyclopropyl-2-[(5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-yl)amino]acetamide
CID 106284971
N-cyclopropyl-2-[(5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-yl)amino]propanamide
CID 106285571
N-(2-cyclopropylpropan-2-yl)-5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-amine
CID 106285865
5-pentan-3-yl-N-(2,2,3-trimethylbutyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 106285842
5-pentan-3-yl-N-(2-phenylcyclopropyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 106285093
5-pentan-3-yl-N-(thiolan-3-ylmethyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 106285741
N-[(4-methylphenyl)methyl]-5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-amine
CID 106284896
N'-cyclopropyl-N'-methyl-N-(5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-yl)ethane-1,2-diamine
CID 114168349

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-amine?
The IUPAC name of N-cyclopropyl-5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-amine (CID 106284732) is N-cyclopropyl-5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-amine.
What is the SMILES notation for N-cyclopropyl-5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-amine?
The canonical SMILES for N-cyclopropyl-5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-amine is CCC(CC)C1CN=C(NC2CC2)S1.
What is the InChIKey of N-cyclopropyl-5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-amine?
The InChIKey is ZBHMNZAJLFVTMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2S/c1-3-8(4-2)10-7-12-11(14-10)13-9-5-6-9/h8-10H,3-7H2,1-2H3,(H,12,13).
What are the key properties of N-cyclopropyl-5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-amine?
N-cyclopropyl-5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-amine has a molecular weight of 212.36 g/mol, XLogP of 2.65, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-amine is sourced from PubChem (CID 106284732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).