5-(ethylaminomethyl)-N,N,4-tripropyl-1,3-thiazol-2-amine

C15H29N3S — CID 55112998

IUPAC5-(ethylaminomethyl)-N,N,4-tripropyl-1,3-thiazol-2-amine
SMILESCCCc1nc(N(CCC)CCC)sc1CNCC
InChIInChI=1S/C15H29N3S/c1-5-9-13-14(12-16-8-4)19-15(17-13)18(10-6-2)11-7-3/h16H,5-12H2,1-4H3
InChIKeyURTVOPHZDFTFOW-UHFFFAOYSA-N
MW283.48 g/mol
LogP3.83
Rot. Bonds10

About 5-(ethylaminomethyl)-N,N,4-tripropyl-1,3-thiazol-2-amine

5-(ethylaminomethyl)-N,N,4-tripropyl-1,3-thiazol-2-amine (PubChem CID 55112998) has the molecular formula C15H29N3S and a molecular weight of 283.48 g/mol. Its IUPAC name is 5-(ethylaminomethyl)-N,N,4-tripropyl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-(ethylaminomethyl)-N,N,4-tripropyl-1,3-thiazol-2-amine
PubChem CID55112998
Molecular FormulaC15H29N3S
Molecular Weight283.48 g/mol
Exact Mass283.21
IUPAC Name5-(ethylaminomethyl)-N,N,4-tripropyl-1,3-thiazol-2-amine
SMILESCCCc1nc(N(CCC)CCC)sc1CNCC
InChIInChI=1S/C15H29N3S/c1-5-9-13-14(12-16-8-4)19-15(17-13)18(10-6-2)11-7-3/h16H,5-12H2,1-4H3
InChIKeyURTVOPHZDFTFOW-UHFFFAOYSA-N
XLogP3.83
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.48
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(ethylaminomethyl)-N,N,4-tripropyl-1,3-thiazol-2-amine?
The IUPAC name of 5-(ethylaminomethyl)-N,N,4-tripropyl-1,3-thiazol-2-amine (CID 55112998) is 5-(ethylaminomethyl)-N,N,4-tripropyl-1,3-thiazol-2-amine.
What is the SMILES notation for 5-(ethylaminomethyl)-N,N,4-tripropyl-1,3-thiazol-2-amine?
The canonical SMILES for 5-(ethylaminomethyl)-N,N,4-tripropyl-1,3-thiazol-2-amine is CCCc1nc(N(CCC)CCC)sc1CNCC.
What is the InChIKey of 5-(ethylaminomethyl)-N,N,4-tripropyl-1,3-thiazol-2-amine?
The InChIKey is URTVOPHZDFTFOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3S/c1-5-9-13-14(12-16-8-4)19-15(17-13)18(10-6-2)11-7-3/h16H,5-12H2,1-4H3.
What are the key properties of 5-(ethylaminomethyl)-N,N,4-tripropyl-1,3-thiazol-2-amine?
5-(ethylaminomethyl)-N,N,4-tripropyl-1,3-thiazol-2-amine has a molecular weight of 283.48 g/mol, XLogP of 3.83, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(ethylaminomethyl)-N,N,4-tripropyl-1,3-thiazol-2-amine is sourced from PubChem (CID 55112998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).