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

C9H16N2OS — CID 63296744

IUPAC5-cyclopropyl-N-(2-methoxyethyl)-4,5-dihydro-1,3-thiazol-2-amine
SMILESCOCCNC1=NCC(C2CC2)S1
InChIInChI=1S/C9H16N2OS/c1-12-5-4-10-9-11-6-8(13-9)7-2-3-7/h7-8H,2-6H2,1H3,(H,10,11)
InChIKeyNYMRXPJPQAHSAH-UHFFFAOYSA-N
MW200.31 g/mol
LogP1.10
Rot. Bonds4

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

5-cyclopropyl-N-(2-methoxyethyl)-4,5-dihydro-1,3-thiazol-2-amine (PubChem CID 63296744) has the molecular formula C9H16N2OS and a molecular weight of 200.31 g/mol. Its IUPAC name is 5-cyclopropyl-N-(2-methoxyethyl)-4,5-dihydro-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-cyclopropyl-N-(2-methoxyethyl)-4,5-dihydro-1,3-thiazol-2-amine
PubChem CID63296744
Molecular FormulaC9H16N2OS
Molecular Weight200.31 g/mol
Exact Mass200.10
IUPAC Name5-cyclopropyl-N-(2-methoxyethyl)-4,5-dihydro-1,3-thiazol-2-amine
SMILESCOCCNC1=NCC(C2CC2)S1
InChIInChI=1S/C9H16N2OS/c1-12-5-4-10-9-11-6-8(13-9)7-2-3-7/h7-8H,2-6H2,1H3,(H,10,11)
InChIKeyNYMRXPJPQAHSAH-UHFFFAOYSA-N
XLogP1.10
TPSA33.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.31
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

5-cyclopropyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]-4,5-dihydro-1,3-thiazol-2-amine
CID 63828097
N-[2-(2,2-difluoroethoxy)ethyl]-5-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine
CID 105916878
5-cyclopropyl-N-[2-(2,2-difluoroethoxy)ethyl]-4,5-dihydro-1,3-thiazol-2-amine
CID 105916890
5-pentan-3-yl-N-[2-(2,2,2-trifluoroethoxy)ethyl]-4,5-dihydro-1,3-thiazol-2-amine
CID 106285293
5-(2-methylpropyl)-N-[2-(2,2,2-trifluoroethoxy)ethyl]-4,5-dihydro-1,3-thiazol-2-amine
CID 107154415
5-propan-2-yl-N-[2-(2,2,2-trifluoroethoxy)ethyl]-4,5-dihydro-1,3-thiazol-2-amine
CID 113492478
N-[2-(2,2-difluoroethoxy)ethyl]-5-(2-methylpropyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 114128335
N-[2-(2,2-difluoroethoxy)ethyl]-5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-amine
CID 114168436
N-(1-methoxypropan-2-yl)-4-(2-methylpropyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 61246534
N-(1-ethoxypropan-2-yl)-4-(2-methylpropyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 61850076
N-[2-(3-methylbutoxy)ethyl]-5,6-dihydro-4H-1,3-thiazin-2-amine
CID 61881793
N-[2-(3-methylbutoxy)ethyl]-4,5-dihydro-1,3-thiazol-2-amine
CID 61881794

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-N-(2-methoxyethyl)-4,5-dihydro-1,3-thiazol-2-amine?
The IUPAC name of 5-cyclopropyl-N-(2-methoxyethyl)-4,5-dihydro-1,3-thiazol-2-amine (CID 63296744) is 5-cyclopropyl-N-(2-methoxyethyl)-4,5-dihydro-1,3-thiazol-2-amine.
What is the SMILES notation for 5-cyclopropyl-N-(2-methoxyethyl)-4,5-dihydro-1,3-thiazol-2-amine?
The canonical SMILES for 5-cyclopropyl-N-(2-methoxyethyl)-4,5-dihydro-1,3-thiazol-2-amine is COCCNC1=NCC(C2CC2)S1.
What is the InChIKey of 5-cyclopropyl-N-(2-methoxyethyl)-4,5-dihydro-1,3-thiazol-2-amine?
The InChIKey is NYMRXPJPQAHSAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2OS/c1-12-5-4-10-9-11-6-8(13-9)7-2-3-7/h7-8H,2-6H2,1H3,(H,10,11).
What are the key properties of 5-cyclopropyl-N-(2-methoxyethyl)-4,5-dihydro-1,3-thiazol-2-amine?
5-cyclopropyl-N-(2-methoxyethyl)-4,5-dihydro-1,3-thiazol-2-amine has a molecular weight of 200.31 g/mol, XLogP of 1.10, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-N-(2-methoxyethyl)-4,5-dihydro-1,3-thiazol-2-amine is sourced from PubChem (CID 63296744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).