N-butan-2-yl-5-[1-(ethylamino)ethyl]-N-(2-methoxyethyl)-1,3-thiazol-2-amine

C14H27N3OS — CID 55111975

IUPACN-butan-2-yl-5-[1-(ethylamino)ethyl]-N-(2-methoxyethyl)-1,3-thiazol-2-amine
SMILESCCNC(C)c1cnc(N(CCOC)C(C)CC)s1
InChIInChI=1S/C14H27N3OS/c1-6-11(3)17(8-9-18-5)14-16-10-13(19-14)12(4)15-7-2/h10-12,15H,6-9H2,1-5H3
InChIKeyIQRCHNXTJIXSTC-UHFFFAOYSA-N
MW285.46 g/mol
LogP3.06
Rot. Bonds9

About N-butan-2-yl-5-[1-(ethylamino)ethyl]-N-(2-methoxyethyl)-1,3-thiazol-2-amine

N-butan-2-yl-5-[1-(ethylamino)ethyl]-N-(2-methoxyethyl)-1,3-thiazol-2-amine (PubChem CID 55111975) has the molecular formula C14H27N3OS and a molecular weight of 285.46 g/mol. Its IUPAC name is N-butan-2-yl-5-[1-(ethylamino)ethyl]-N-(2-methoxyethyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-butan-2-yl-5-[1-(ethylamino)ethyl]-N-(2-methoxyethyl)-1,3-thiazol-2-amine
PubChem CID55111975
Molecular FormulaC14H27N3OS
Molecular Weight285.46 g/mol
Exact Mass285.19
IUPAC NameN-butan-2-yl-5-[1-(ethylamino)ethyl]-N-(2-methoxyethyl)-1,3-thiazol-2-amine
SMILESCCNC(C)c1cnc(N(CCOC)C(C)CC)s1
InChIInChI=1S/C14H27N3OS/c1-6-11(3)17(8-9-18-5)14-16-10-13(19-14)12(4)15-7-2/h10-12,15H,6-9H2,1-5H3
InChIKeyIQRCHNXTJIXSTC-UHFFFAOYSA-N
XLogP3.06
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.46
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-butan-2-yl-N-butyl-5-[1-(ethylamino)ethyl]-1,3-thiazol-2-amine
CID 62752426
N-ethyl-5-[1-(ethylamino)ethyl]-N-propyl-1,3-thiazol-2-amine
CID 62750257
5-[1-(ethylamino)ethyl]-N-methyl-N-pentan-3-yl-1,3-thiazol-2-amine
CID 55112349
5-[1-(ethylamino)ethyl]-N-methyl-N-(3-methylbutyl)-1,3-thiazol-2-amine
CID 62754150
5-(ethylaminomethyl)-N-(2-methoxyethyl)-N-propan-2-yl-1,3-thiazol-2-amine
CID 82966301
N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-5-(methylaminomethyl)-1,3-thiazol-2-amine
CID 62752566
N-(2-methoxyethyl)-5-(methylaminomethyl)-N-pentan-3-yl-1,3-thiazol-2-amine
CID 55112407
N-(2-methoxyethyl)-5-[(2-methylpropylamino)methyl]-N-pentan-3-yl-1,3-thiazol-2-amine
CID 62752928
5-[1-(ethylamino)ethyl]-N-methyl-N-(1-methylpiperidin-4-yl)-1,3-thiazol-2-amine
CID 55113578
2-bromo-N-butan-2-yl-4-[1-(ethylamino)ethyl]-N-(2-methoxyethyl)aniline
CID 62912370
N-butan-2-yl-5-(ethylaminomethyl)-N-(2-methoxyethyl)-3-methylpyridin-2-amine
CID 80630535
5-[1-(ethylamino)ethyl]-N-methyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]-1,3-thiazol-2-amine
CID 63840146

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-5-[1-(ethylamino)ethyl]-N-(2-methoxyethyl)-1,3-thiazol-2-amine?
The IUPAC name of N-butan-2-yl-5-[1-(ethylamino)ethyl]-N-(2-methoxyethyl)-1,3-thiazol-2-amine (CID 55111975) is N-butan-2-yl-5-[1-(ethylamino)ethyl]-N-(2-methoxyethyl)-1,3-thiazol-2-amine.
What is the SMILES notation for N-butan-2-yl-5-[1-(ethylamino)ethyl]-N-(2-methoxyethyl)-1,3-thiazol-2-amine?
The canonical SMILES for N-butan-2-yl-5-[1-(ethylamino)ethyl]-N-(2-methoxyethyl)-1,3-thiazol-2-amine is CCNC(C)c1cnc(N(CCOC)C(C)CC)s1.
What is the InChIKey of N-butan-2-yl-5-[1-(ethylamino)ethyl]-N-(2-methoxyethyl)-1,3-thiazol-2-amine?
The InChIKey is IQRCHNXTJIXSTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3OS/c1-6-11(3)17(8-9-18-5)14-16-10-13(19-14)12(4)15-7-2/h10-12,15H,6-9H2,1-5H3.
What are the key properties of N-butan-2-yl-5-[1-(ethylamino)ethyl]-N-(2-methoxyethyl)-1,3-thiazol-2-amine?
N-butan-2-yl-5-[1-(ethylamino)ethyl]-N-(2-methoxyethyl)-1,3-thiazol-2-amine has a molecular weight of 285.46 g/mol, XLogP of 3.06, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-5-[1-(ethylamino)ethyl]-N-(2-methoxyethyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 55111975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).