(1R)-1-(furan-2-yl)-N-(1,3-thiazol-4-ylmethyl)ethanamine

C10H12N2OS — CID 81401203

IUPAC(1R)-1-(furan-2-yl)-N-(1,3-thiazol-4-ylmethyl)ethanamine
SMILESC[C@@H](NCc1cscn1)c1ccco1
InChIInChI=1S/C10H12N2OS/c1-8(10-3-2-4-13-10)11-5-9-6-14-7-12-9/h2-4,6-8,11H,5H2,1H3/t8-/m1/s1
InChIKeyCKSXYQVCLDVPKI-MRVPVSSYSA-N
MW208.29 g/mol
LogP2.59
Rot. Bonds4

About (1R)-1-(furan-2-yl)-N-(1,3-thiazol-4-ylmethyl)ethanamine

(1R)-1-(furan-2-yl)-N-(1,3-thiazol-4-ylmethyl)ethanamine (PubChem CID 81401203) has the molecular formula C10H12N2OS and a molecular weight of 208.29 g/mol. Its IUPAC name is (1R)-1-(furan-2-yl)-N-(1,3-thiazol-4-ylmethyl)ethanamine.

Molecular Properties

Compound Name(1R)-1-(furan-2-yl)-N-(1,3-thiazol-4-ylmethyl)ethanamine
PubChem CID81401203
Molecular FormulaC10H12N2OS
Molecular Weight208.29 g/mol
Exact Mass208.07
IUPAC Name(1R)-1-(furan-2-yl)-N-(1,3-thiazol-4-ylmethyl)ethanamine
SMILESC[C@@H](NCc1cscn1)c1ccco1
InChIInChI=1S/C10H12N2OS/c1-8(10-3-2-4-13-10)11-5-9-6-14-7-12-9/h2-4,6-8,11H,5H2,1H3/t8-/m1/s1
InChIKeyCKSXYQVCLDVPKI-MRVPVSSYSA-N
XLogP2.59
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.29
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(furan-2-yl)-2-(2-methylpropoxy)-N-(1,3-thiazol-4-ylmethyl)ethanamine
CID 119106924
1-(5-methylfuran-2-yl)-N-(1,3-thiazol-4-ylmethyl)ethanamine
CID 60698178
N-(1,3-thiazol-4-ylmethyl)-1-thiophen-2-ylethanamine
CID 60696751
(1S)-1-(2-methylphenyl)-N-(1,3-thiazol-4-ylmethyl)ethanamine
CID 81375362
(1S)-1-(4-methylphenyl)-N-(1,3-thiazol-4-ylmethyl)ethanamine
CID 81349492
1-(furan-2-yl)-N-(1,3-thiazol-5-ylmethyl)ethanamine
CID 62758862
(1R)-1-(furan-2-yl)-N-[(4-methyl-1,3-thiazol-5-yl)methyl]ethanamine
CID 81403760
1-(furan-2-yl)-N-[(4-methyl-1,3-thiazol-5-yl)methyl]ethanamine
CID 63280404
(1S)-1-(furan-2-yl)-N-(1,3-thiazol-2-ylmethyl)ethanamine
CID 81403465
(1R)-1-(4-bromophenyl)-N-(1,3-thiazol-4-ylmethyl)ethanamine
CID 78921782
(1R)-1-(furan-2-yl)-N-(quinoxalin-2-ylmethyl)ethanamine
CID 81400826
1-(furan-2-yl)-N-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]ethanamine
CID 43234418

Frequently Asked Questions

What is the IUPAC name of (1R)-1-(furan-2-yl)-N-(1,3-thiazol-4-ylmethyl)ethanamine?
The IUPAC name of (1R)-1-(furan-2-yl)-N-(1,3-thiazol-4-ylmethyl)ethanamine (CID 81401203) is (1R)-1-(furan-2-yl)-N-(1,3-thiazol-4-ylmethyl)ethanamine.
What is the SMILES notation for (1R)-1-(furan-2-yl)-N-(1,3-thiazol-4-ylmethyl)ethanamine?
The canonical SMILES for (1R)-1-(furan-2-yl)-N-(1,3-thiazol-4-ylmethyl)ethanamine is C[C@@H](NCc1cscn1)c1ccco1.
What is the InChIKey of (1R)-1-(furan-2-yl)-N-(1,3-thiazol-4-ylmethyl)ethanamine?
The InChIKey is CKSXYQVCLDVPKI-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H12N2OS/c1-8(10-3-2-4-13-10)11-5-9-6-14-7-12-9/h2-4,6-8,11H,5H2,1H3/t8-/m1/s1.
What are the key properties of (1R)-1-(furan-2-yl)-N-(1,3-thiazol-4-ylmethyl)ethanamine?
(1R)-1-(furan-2-yl)-N-(1,3-thiazol-4-ylmethyl)ethanamine has a molecular weight of 208.29 g/mol, XLogP of 2.59, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(furan-2-yl)-N-(1,3-thiazol-4-ylmethyl)ethanamine is sourced from PubChem (CID 81401203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).