2-ethoxy-N-[(2-ethyl-1,3-thiazol-5-yl)methyl]aniline

C14H18N2OS — CID 54883651

IUPAC2-ethoxy-N-[(2-ethyl-1,3-thiazol-5-yl)methyl]aniline
SMILESCCOc1ccccc1NCc1cnc(CC)s1
InChIInChI=1S/C14H18N2OS/c1-3-14-16-10-11(18-14)9-15-12-7-5-6-8-13(12)17-4-2/h5-8,10,15H,3-4,9H2,1-2H3
InChIKeyWONSZGSJGODRQZ-UHFFFAOYSA-N
MW262.38 g/mol
LogP3.72
Rot. Bonds6

About 2-ethoxy-N-[(2-ethyl-1,3-thiazol-5-yl)methyl]aniline

2-ethoxy-N-[(2-ethyl-1,3-thiazol-5-yl)methyl]aniline (PubChem CID 54883651) has the molecular formula C14H18N2OS and a molecular weight of 262.38 g/mol. Its IUPAC name is 2-ethoxy-N-[(2-ethyl-1,3-thiazol-5-yl)methyl]aniline.

Molecular Properties

Compound Name2-ethoxy-N-[(2-ethyl-1,3-thiazol-5-yl)methyl]aniline
PubChem CID54883651
Molecular FormulaC14H18N2OS
Molecular Weight262.38 g/mol
Exact Mass262.11
IUPAC Name2-ethoxy-N-[(2-ethyl-1,3-thiazol-5-yl)methyl]aniline
SMILESCCOc1ccccc1NCc1cnc(CC)s1
InChIInChI=1S/C14H18N2OS/c1-3-14-16-10-11(18-14)9-15-12-7-5-6-8-13(12)17-4-2/h5-8,10,15H,3-4,9H2,1-2H3
InChIKeyWONSZGSJGODRQZ-UHFFFAOYSA-N
XLogP3.72
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.38
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2-ethyl-1,3-thiazol-5-yl)methyl]-2-methoxyaniline
CID 54883557
N-[(2-tert-butyl-1,3-thiazol-5-yl)methyl]-2-ethoxyaniline
CID 63120786
N-[(2-ethyl-1,3-thiazol-5-yl)methyl]-2-methylaniline
CID 60983133
N-[(2-ethyl-1,3-thiazol-5-yl)methyl]-2-phenylaniline
CID 60982356
N-[(2-ethyl-1,3-thiazol-5-yl)methyl]-5-fluoro-2-methylaniline
CID 54883805
5-[(2-ethoxyanilino)methyl]thiophene-2-carbonitrile
CID 113250104
N-[(2-ethyl-1,3-thiazol-5-yl)methyl]-2-pyrrolidin-1-ylpyridin-3-amine
CID 60982261
3-[(2-ethyl-1,3-thiazol-5-yl)methylamino]-4-methoxybenzoic acid
CID 63742291
N-[(4-bromothiophen-2-yl)methyl]-2-ethoxyaniline
CID 28972860
N-[(2-ethyl-1,3-thiazol-5-yl)methyl]-2-methoxy-4-nitroaniline
CID 60982910
N-[3-[(2-ethyl-1,3-thiazol-5-yl)methylamino]-4-methoxyphenyl]acetamide
CID 60982787
N-[(2-ethyl-1,3-thiazol-5-yl)methyl]-5-methoxy-2-methylaniline
CID 113268236

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-[(2-ethyl-1,3-thiazol-5-yl)methyl]aniline?
The IUPAC name of 2-ethoxy-N-[(2-ethyl-1,3-thiazol-5-yl)methyl]aniline (CID 54883651) is 2-ethoxy-N-[(2-ethyl-1,3-thiazol-5-yl)methyl]aniline.
What is the SMILES notation for 2-ethoxy-N-[(2-ethyl-1,3-thiazol-5-yl)methyl]aniline?
The canonical SMILES for 2-ethoxy-N-[(2-ethyl-1,3-thiazol-5-yl)methyl]aniline is CCOc1ccccc1NCc1cnc(CC)s1.
What is the InChIKey of 2-ethoxy-N-[(2-ethyl-1,3-thiazol-5-yl)methyl]aniline?
The InChIKey is WONSZGSJGODRQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2OS/c1-3-14-16-10-11(18-14)9-15-12-7-5-6-8-13(12)17-4-2/h5-8,10,15H,3-4,9H2,1-2H3.
What are the key properties of 2-ethoxy-N-[(2-ethyl-1,3-thiazol-5-yl)methyl]aniline?
2-ethoxy-N-[(2-ethyl-1,3-thiazol-5-yl)methyl]aniline has a molecular weight of 262.38 g/mol, XLogP of 3.72, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-[(2-ethyl-1,3-thiazol-5-yl)methyl]aniline is sourced from PubChem (CID 54883651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).