4-cyclopropyl-N-(2-methoxyethyl)-5-(methylaminomethyl)-N-propan-2-yl-1,3-thiazol-2-amine

C14H25N3OS — CID 82965606

IUPAC4-cyclopropyl-N-(2-methoxyethyl)-5-(methylaminomethyl)-N-propan-2-yl-1,3-thiazol-2-amine
SMILESCNCc1sc(N(CCOC)C(C)C)nc1C1CC1
InChIInChI=1S/C14H25N3OS/c1-10(2)17(7-8-18-4)14-16-13(11-5-6-11)12(19-14)9-15-3/h10-11,15H,5-9H2,1-4H3
InChIKeyXNSNXINLNYTYIB-UHFFFAOYSA-N
MW283.44 g/mol
LogP2.60
Rot. Bonds8

About 4-cyclopropyl-N-(2-methoxyethyl)-5-(methylaminomethyl)-N-propan-2-yl-1,3-thiazol-2-amine

4-cyclopropyl-N-(2-methoxyethyl)-5-(methylaminomethyl)-N-propan-2-yl-1,3-thiazol-2-amine (PubChem CID 82965606) has the molecular formula C14H25N3OS and a molecular weight of 283.44 g/mol. Its IUPAC name is 4-cyclopropyl-N-(2-methoxyethyl)-5-(methylaminomethyl)-N-propan-2-yl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-cyclopropyl-N-(2-methoxyethyl)-5-(methylaminomethyl)-N-propan-2-yl-1,3-thiazol-2-amine
PubChem CID82965606
Molecular FormulaC14H25N3OS
Molecular Weight283.44 g/mol
Exact Mass283.17
IUPAC Name4-cyclopropyl-N-(2-methoxyethyl)-5-(methylaminomethyl)-N-propan-2-yl-1,3-thiazol-2-amine
SMILESCNCc1sc(N(CCOC)C(C)C)nc1C1CC1
InChIInChI=1S/C14H25N3OS/c1-10(2)17(7-8-18-4)14-16-13(11-5-6-11)12(19-14)9-15-3/h10-11,15H,5-9H2,1-4H3
InChIKeyXNSNXINLNYTYIB-UHFFFAOYSA-N
XLogP2.60
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.44
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-cyclopropyl-N-(2-methoxyethyl)-5-(methylaminomethyl)-N-propan-2-yl-1,3-thiazol-2-amine?
The IUPAC name of 4-cyclopropyl-N-(2-methoxyethyl)-5-(methylaminomethyl)-N-propan-2-yl-1,3-thiazol-2-amine (CID 82965606) is 4-cyclopropyl-N-(2-methoxyethyl)-5-(methylaminomethyl)-N-propan-2-yl-1,3-thiazol-2-amine.
What is the SMILES notation for 4-cyclopropyl-N-(2-methoxyethyl)-5-(methylaminomethyl)-N-propan-2-yl-1,3-thiazol-2-amine?
The canonical SMILES for 4-cyclopropyl-N-(2-methoxyethyl)-5-(methylaminomethyl)-N-propan-2-yl-1,3-thiazol-2-amine is CNCc1sc(N(CCOC)C(C)C)nc1C1CC1.
What is the InChIKey of 4-cyclopropyl-N-(2-methoxyethyl)-5-(methylaminomethyl)-N-propan-2-yl-1,3-thiazol-2-amine?
The InChIKey is XNSNXINLNYTYIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3OS/c1-10(2)17(7-8-18-4)14-16-13(11-5-6-11)12(19-14)9-15-3/h10-11,15H,5-9H2,1-4H3.
What are the key properties of 4-cyclopropyl-N-(2-methoxyethyl)-5-(methylaminomethyl)-N-propan-2-yl-1,3-thiazol-2-amine?
4-cyclopropyl-N-(2-methoxyethyl)-5-(methylaminomethyl)-N-propan-2-yl-1,3-thiazol-2-amine has a molecular weight of 283.44 g/mol, XLogP of 2.60, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropyl-N-(2-methoxyethyl)-5-(methylaminomethyl)-N-propan-2-yl-1,3-thiazol-2-amine is sourced from PubChem (CID 82965606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).