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

C10H12N2OS — CID 81403465

IUPAC(1S)-1-(furan-2-yl)-N-(1,3-thiazol-2-ylmethyl)ethanamine
SMILESC[C@H](NCc1nccs1)c1ccco1
InChIInChI=1S/C10H12N2OS/c1-8(9-3-2-5-13-9)12-7-10-11-4-6-14-10/h2-6,8,12H,7H2,1H3/t8-/m0/s1
InChIKeyOFQQAYCVYURGDH-QMMMGPOBSA-N
MW208.29 g/mol
LogP2.59
Rot. Bonds4

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

(1S)-1-(furan-2-yl)-N-(1,3-thiazol-2-ylmethyl)ethanamine (PubChem CID 81403465) has the molecular formula C10H12N2OS and a molecular weight of 208.29 g/mol. Its IUPAC name is (1S)-1-(furan-2-yl)-N-(1,3-thiazol-2-ylmethyl)ethanamine.

Molecular Properties

Compound Name(1S)-1-(furan-2-yl)-N-(1,3-thiazol-2-ylmethyl)ethanamine
PubChem CID81403465
Molecular FormulaC10H12N2OS
Molecular Weight208.29 g/mol
Exact Mass208.07
IUPAC Name(1S)-1-(furan-2-yl)-N-(1,3-thiazol-2-ylmethyl)ethanamine
SMILESC[C@H](NCc1nccs1)c1ccco1
InChIInChI=1S/C10H12N2OS/c1-8(9-3-2-5-13-9)12-7-10-11-4-6-14-10/h2-6,8,12H,7H2,1H3/t8-/m0/s1
InChIKeyOFQQAYCVYURGDH-QMMMGPOBSA-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

N-[1-(furan-2-yl)ethyl]-2-(1,3-thiazol-2-yl)propan-1-amine
CID 104585128
1-(furan-2-yl)-1-(1-methylimidazol-2-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine
CID 61284438
2-[[[(1R)-1-(furan-2-yl)ethyl]amino]methyl]thiophen-3-amine
CID 81403332
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
(1R)-N-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-1-(furan-2-yl)ethanamine
CID 81400388
(1S)-1-pyridin-4-yl-N-(1,3-thiazol-2-ylmethyl)ethanamine
CID 81406357
1-(4-propan-2-ylphenyl)-N-(1,3-thiazol-2-ylmethyl)ethanamine
CID 61285618
1-(furan-2-yl)-N-methyl-2-(1,3-thiazol-2-yl)ethanamine
CID 79825248
2-methyl-N-(1,3-thiazol-2-ylmethyl)-1-thiophen-2-ylpropan-1-amine
CID 61284440
(1S)-1-(2-chlorophenyl)-N-(1,3-thiazol-2-ylmethyl)ethanamine
CID 81377691

Frequently Asked Questions

What is the IUPAC name of (1S)-1-(furan-2-yl)-N-(1,3-thiazol-2-ylmethyl)ethanamine?
The IUPAC name of (1S)-1-(furan-2-yl)-N-(1,3-thiazol-2-ylmethyl)ethanamine (CID 81403465) is (1S)-1-(furan-2-yl)-N-(1,3-thiazol-2-ylmethyl)ethanamine.
What is the SMILES notation for (1S)-1-(furan-2-yl)-N-(1,3-thiazol-2-ylmethyl)ethanamine?
The canonical SMILES for (1S)-1-(furan-2-yl)-N-(1,3-thiazol-2-ylmethyl)ethanamine is C[C@H](NCc1nccs1)c1ccco1.
What is the InChIKey of (1S)-1-(furan-2-yl)-N-(1,3-thiazol-2-ylmethyl)ethanamine?
The InChIKey is OFQQAYCVYURGDH-QMMMGPOBSA-N. The full InChI is InChI=1S/C10H12N2OS/c1-8(9-3-2-5-13-9)12-7-10-11-4-6-14-10/h2-6,8,12H,7H2,1H3/t8-/m0/s1.
What are the key properties of (1S)-1-(furan-2-yl)-N-(1,3-thiazol-2-ylmethyl)ethanamine?
(1S)-1-(furan-2-yl)-N-(1,3-thiazol-2-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 (1S)-1-(furan-2-yl)-N-(1,3-thiazol-2-ylmethyl)ethanamine is sourced from PubChem (CID 81403465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).