N-cyclopropyl-4-[1-(ethylamino)ethyl]-N-(thiophen-3-ylmethyl)-1,3-thiazol-2-amine

C15H21N3S2 — CID 64543556

IUPACN-cyclopropyl-4-[1-(ethylamino)ethyl]-N-(thiophen-3-ylmethyl)-1,3-thiazol-2-amine
SMILESCCNC(C)c1csc(N(Cc2ccsc2)C2CC2)n1
InChIInChI=1S/C15H21N3S2/c1-3-16-11(2)14-10-20-15(17-14)18(13-4-5-13)8-12-6-7-19-9-12/h6-7,9-11,13,16H,3-5,8H2,1-2H3
InChIKeyHPAVNNWCAFJYRS-UHFFFAOYSA-N
MW307.49 g/mol
LogP4.04
Rot. Bonds7

About N-cyclopropyl-4-[1-(ethylamino)ethyl]-N-(thiophen-3-ylmethyl)-1,3-thiazol-2-amine

N-cyclopropyl-4-[1-(ethylamino)ethyl]-N-(thiophen-3-ylmethyl)-1,3-thiazol-2-amine (PubChem CID 64543556) has the molecular formula C15H21N3S2 and a molecular weight of 307.49 g/mol. Its IUPAC name is N-cyclopropyl-4-[1-(ethylamino)ethyl]-N-(thiophen-3-ylmethyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-cyclopropyl-4-[1-(ethylamino)ethyl]-N-(thiophen-3-ylmethyl)-1,3-thiazol-2-amine
PubChem CID64543556
Molecular FormulaC15H21N3S2
Molecular Weight307.49 g/mol
Exact Mass307.12
IUPAC NameN-cyclopropyl-4-[1-(ethylamino)ethyl]-N-(thiophen-3-ylmethyl)-1,3-thiazol-2-amine
SMILESCCNC(C)c1csc(N(Cc2ccsc2)C2CC2)n1
InChIInChI=1S/C15H21N3S2/c1-3-16-11(2)14-10-20-15(17-14)18(13-4-5-13)8-12-6-7-19-9-12/h6-7,9-11,13,16H,3-5,8H2,1-2H3
InChIKeyHPAVNNWCAFJYRS-UHFFFAOYSA-N
XLogP4.04
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.49
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclopropyl-4-[1-(ethylamino)ethyl]-N-(2-methylpropyl)-1,3-thiazol-2-amine
CID 64543352
N-butyl-N-cyclopropyl-4-[1-(ethylamino)ethyl]-1,3-thiazol-2-amine
CID 64544356
4-[1-(ethylamino)ethyl]-N,N-dimethyl-1,3-thiazol-2-amine
CID 64542711
N,N-diethyl-4-[1-(ethylamino)ethyl]-1,3-thiazol-2-amine
CID 64542709
N-cyclohexyl-N-ethyl-4-[1-(propylamino)ethyl]-1,3-thiazol-2-amine
CID 64544326
4-[1-(ethylamino)ethyl]-N-[(3-fluorophenyl)methyl]-N-methyl-1,3-thiazol-2-amine
CID 64542716
4-[1-(ethylamino)ethyl]-N-methyl-N-propan-2-yl-1,3-thiazol-2-amine
CID 64545140
N-(cyclopentylmethyl)-4-[1-(ethylamino)ethyl]-N-methyl-1,3-thiazol-2-amine
CID 64544590
3-N-cyclopropyl-3-N-(thiophen-3-ylmethyl)butane-1,3-diamine
CID 61433840
4-[1-(ethylamino)ethyl]-N-(4-fluorophenyl)-N-methyl-1,3-thiazol-2-amine
CID 64544155
4-(1-aminoethyl)-N-cyclopropyl-N-ethyl-1,3-thiazol-2-amine
CID 64543335
4-[1-(ethylamino)ethyl]-N-methyl-N-(3-methylbutan-2-yl)-1,3-thiazol-2-amine
CID 64542925

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-[1-(ethylamino)ethyl]-N-(thiophen-3-ylmethyl)-1,3-thiazol-2-amine?
The IUPAC name of N-cyclopropyl-4-[1-(ethylamino)ethyl]-N-(thiophen-3-ylmethyl)-1,3-thiazol-2-amine (CID 64543556) is N-cyclopropyl-4-[1-(ethylamino)ethyl]-N-(thiophen-3-ylmethyl)-1,3-thiazol-2-amine.
What is the SMILES notation for N-cyclopropyl-4-[1-(ethylamino)ethyl]-N-(thiophen-3-ylmethyl)-1,3-thiazol-2-amine?
The canonical SMILES for N-cyclopropyl-4-[1-(ethylamino)ethyl]-N-(thiophen-3-ylmethyl)-1,3-thiazol-2-amine is CCNC(C)c1csc(N(Cc2ccsc2)C2CC2)n1.
What is the InChIKey of N-cyclopropyl-4-[1-(ethylamino)ethyl]-N-(thiophen-3-ylmethyl)-1,3-thiazol-2-amine?
The InChIKey is HPAVNNWCAFJYRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3S2/c1-3-16-11(2)14-10-20-15(17-14)18(13-4-5-13)8-12-6-7-19-9-12/h6-7,9-11,13,16H,3-5,8H2,1-2H3.
What are the key properties of N-cyclopropyl-4-[1-(ethylamino)ethyl]-N-(thiophen-3-ylmethyl)-1,3-thiazol-2-amine?
N-cyclopropyl-4-[1-(ethylamino)ethyl]-N-(thiophen-3-ylmethyl)-1,3-thiazol-2-amine has a molecular weight of 307.49 g/mol, XLogP of 4.04, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-[1-(ethylamino)ethyl]-N-(thiophen-3-ylmethyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 64543556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).