(1S)-N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-(furan-2-yl)ethanamine

C14H14ClN3O — CID 115345178

IUPAC(1S)-N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-(furan-2-yl)ethanamine
SMILESC[C@H](NCc1cn2cc(Cl)ccc2n1)c1ccco1
InChIInChI=1S/C14H14ClN3O/c1-10(13-3-2-6-19-13)16-7-12-9-18-8-11(15)4-5-14(18)17-12/h2-6,8-10,16H,7H2,1H3/t10-/m0/s1
InChIKeyYUORXVYFRAGNHI-JTQLQIEISA-N
MW275.74 g/mol
LogP3.43
Rot. Bonds4

About (1S)-N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-(furan-2-yl)ethanamine

(1S)-N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-(furan-2-yl)ethanamine (PubChem CID 115345178) has the molecular formula C14H14ClN3O and a molecular weight of 275.74 g/mol. Its IUPAC name is (1S)-N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-(furan-2-yl)ethanamine.

Molecular Properties

Compound Name(1S)-N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-(furan-2-yl)ethanamine
PubChem CID115345178
Molecular FormulaC14H14ClN3O
Molecular Weight275.74 g/mol
Exact Mass275.08
IUPAC Name(1S)-N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-(furan-2-yl)ethanamine
SMILESC[C@H](NCc1cn2cc(Cl)ccc2n1)c1ccco1
InChIInChI=1S/C14H14ClN3O/c1-10(13-3-2-6-19-13)16-7-12-9-18-8-11(15)4-5-14(18)17-12/h2-6,8-10,16H,7H2,1H3/t10-/m0/s1
InChIKeyYUORXVYFRAGNHI-JTQLQIEISA-N
XLogP3.43
TPSA42.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.74
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-4-(furan-2-yl)butan-2-amine
CID 78915531
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3,3-dimethylbutan-2-amine
CID 115625717
2-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]-N,N-dimethylpropanamide
CID 78959550
(1R)-N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-cyclopentylethanamine
CID 115345173
3-N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-N,1-N-dimethylbutane-1,3-diamine
CID 78960376
(2S,3R)-N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3-pyrazol-1-ylbutan-2-amine
CID 95329802
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3-methyl-2-propan-2-ylbutan-1-amine
CID 102905572
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]aniline
CID 78912513
(1S)-N-[(2,4-dichlorophenyl)methyl]-1-(furan-2-yl)ethanamine
CID 81403890
(1R)-1-(furan-2-yl)-N-[(1-methylpyrazol-3-yl)methyl]ethanamine
CID 82867029
1-(6-chloroimidazo[1,2-a]pyridin-2-yl)-N-[(1-propan-2-ylcyclopropyl)methyl]methanamine
CID 103743352
6-chloro-2-[(2-fluorophenyl)methyl]imidazo[1,2-a]pyridine
CID 117130490

Frequently Asked Questions

What is the IUPAC name of (1S)-N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-(furan-2-yl)ethanamine?
The IUPAC name of (1S)-N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-(furan-2-yl)ethanamine (CID 115345178) is (1S)-N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-(furan-2-yl)ethanamine.
What is the SMILES notation for (1S)-N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-(furan-2-yl)ethanamine?
The canonical SMILES for (1S)-N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-(furan-2-yl)ethanamine is C[C@H](NCc1cn2cc(Cl)ccc2n1)c1ccco1.
What is the InChIKey of (1S)-N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-(furan-2-yl)ethanamine?
The InChIKey is YUORXVYFRAGNHI-JTQLQIEISA-N. The full InChI is InChI=1S/C14H14ClN3O/c1-10(13-3-2-6-19-13)16-7-12-9-18-8-11(15)4-5-14(18)17-12/h2-6,8-10,16H,7H2,1H3/t10-/m0/s1.
What are the key properties of (1S)-N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-(furan-2-yl)ethanamine?
(1S)-N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-(furan-2-yl)ethanamine has a molecular weight of 275.74 g/mol, XLogP of 3.43, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-(furan-2-yl)ethanamine is sourced from PubChem (CID 115345178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).