5-[1-(ethylamino)ethyl]-N-methyl-N-(3-methylbutyl)-1,3-thiazol-2-amine

Name: 5-[1-(ethylamino)ethyl]-N-methyl-N-(3-methylbutyl)-1,3-thiazol-2-amine — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₃H₂₅N₃S — CID 62754150

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPAC5-[1-(ethylamino)ethyl]-N-methyl-N-(3-methylbutyl)-1,3-thiazol-2-amine

SMILESCCNC(C)c1cnc(N(C)CCC(C)C)s1

InChIInChI=1S/C13H25N3S/c1-6-14-11(4)12-9-15-13(17-12)16(5)8-7-10(2)3/h9-11,14H,6-8H2,1-5H3

InChIKeyVHMAWHPDHILSBZ-UHFFFAOYSA-N

MW255.43 g/mol

LogP3.30

Rot. Bonds7

About 5-[1-(ethylamino)ethyl]-N-methyl-N-(3-methylbutyl)-1,3-thiazol-2-amine

5-[1-(ethylamino)ethyl]-N-methyl-N-(3-methylbutyl)-1,3-thiazol-2-amine (PubChem CID 62754150) has the molecular formula C₁₃H₂₅N₃S and a molecular weight of 255.43 g/mol. Its IUPAC name is 5-[1-(ethylamino)ethyl]-N-methyl-N-(3-methylbutyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name	5-[1-(ethylamino)ethyl]-N-methyl-N-(3-methylbutyl)-1,3-thiazol-2-amine
PubChem CID	62754150
Molecular Formula	C₁₃H₂₅N₃S
Molecular Weight	255.43 g/mol
Exact Mass	255.18
IUPAC Name	5-[1-(ethylamino)ethyl]-N-methyl-N-(3-methylbutyl)-1,3-thiazol-2-amine
SMILES	CCNC(C)c1cnc(N(C)CCC(C)C)s1
InChI	InChI=1S/C13H25N3S/c1-6-14-11(4)12-9-15-13(17-12)16(5)8-7-10(2)3/h9-11,14H,6-8H2,1-5H3
InChIKey	VHMAWHPDHILSBZ-UHFFFAOYSA-N
XLogP	3.30
TPSA	28.16 Å²
H-Bond Donors	1
H-Bond Acceptors	4
Rotatable Bonds	7
Heavy Atoms	17
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	255.43
LogP ≤ 5	3.30
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of 5-[1-(ethylamino)ethyl]-N-methyl-N-(3-methylbutyl)-1,3-thiazol-2-amine?

The IUPAC name of 5-[1-(ethylamino)ethyl]-N-methyl-N-(3-methylbutyl)-1,3-thiazol-2-amine (CID 62754150) is 5-[1-(ethylamino)ethyl]-N-methyl-N-(3-methylbutyl)-1,3-thiazol-2-amine.

What is the SMILES notation for 5-[1-(ethylamino)ethyl]-N-methyl-N-(3-methylbutyl)-1,3-thiazol-2-amine?

The canonical SMILES for 5-[1-(ethylamino)ethyl]-N-methyl-N-(3-methylbutyl)-1,3-thiazol-2-amine is CCNC(C)c1cnc(N(C)CCC(C)C)s1.

What is the InChIKey of 5-[1-(ethylamino)ethyl]-N-methyl-N-(3-methylbutyl)-1,3-thiazol-2-amine?

The InChIKey is VHMAWHPDHILSBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3S/c1-6-14-11(4)12-9-15-13(17-12)16(5)8-7-10(2)3/h9-11,14H,6-8H2,1-5H3.

What are the key properties of 5-[1-(ethylamino)ethyl]-N-methyl-N-(3-methylbutyl)-1,3-thiazol-2-amine?

5-[1-(ethylamino)ethyl]-N-methyl-N-(3-methylbutyl)-1,3-thiazol-2-amine has a molecular weight of 255.43 g/mol, XLogP of 3.30, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 5-[1-(ethylamino)ethyl]-N-methyl-N-(3-methylbutyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 62754150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 62754150 — identifiers, structure, computed properties (public domain)

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