(2-chlorofuran-3-yl)-(1,2-thiazol-5-yl)methanamine

C8H7ClN2OS — CID 131015361

IUPAC(2-chlorofuran-3-yl)-(1,2-thiazol-5-yl)methanamine
SMILESNC(c1ccns1)c1ccoc1Cl
InChIInChI=1S/C8H7ClN2OS/c9-8-5(2-4-12-8)7(10)6-1-3-11-13-6/h1-4,7H,10H2
InChIKeyDNRKZQSEKYRHSI-UHFFFAOYSA-N
MW214.68 g/mol
LogP2.44
Rot. Bonds2

About (2-chlorofuran-3-yl)-(1,2-thiazol-5-yl)methanamine

(2-chlorofuran-3-yl)-(1,2-thiazol-5-yl)methanamine (PubChem CID 131015361) has the molecular formula C8H7ClN2OS and a molecular weight of 214.68 g/mol. Its IUPAC name is (2-chlorofuran-3-yl)-(1,2-thiazol-5-yl)methanamine.

Molecular Properties

Compound Name(2-chlorofuran-3-yl)-(1,2-thiazol-5-yl)methanamine
PubChem CID131015361
Molecular FormulaC8H7ClN2OS
Molecular Weight214.68 g/mol
Exact Mass214.00
IUPAC Name(2-chlorofuran-3-yl)-(1,2-thiazol-5-yl)methanamine
SMILESNC(c1ccns1)c1ccoc1Cl
InChIInChI=1S/C8H7ClN2OS/c9-8-5(2-4-12-8)7(10)6-1-3-11-13-6/h1-4,7H,10H2
InChIKeyDNRKZQSEKYRHSI-UHFFFAOYSA-N
XLogP2.44
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.68
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(5-bromofuran-3-yl)-(1,2-thiazol-5-yl)methanamine
CID 130855940
5-(dichloromethyl)-1,2-thiazole
CID 174910086
1-(2-chlorofuran-3-yl)-2-ethylbutan-1-amine
CID 106692648
(2-chlorofuran-3-yl)-(2-propylpyrazol-3-yl)methanamine
CID 106692049
(2-chlorofuran-3-yl)-(2-propan-2-yloxyphenyl)methanamine
CID 106692739
(2-chlorofuran-3-yl)-[2-(trifluoromethoxy)phenyl]methanamine
CID 106691908
(2-chlorofuran-3-yl)-(7-methyl-1-benzofuran-2-yl)methanamine
CID 106693197
(4-methylthiophen-2-yl)-(1,2-thiazol-5-yl)methanamine
CID 131015174
(3-iodothiophen-2-yl)-(1,2-thiazol-5-yl)methanamine
CID 130914169
(4-chlorophenyl)-(1,2-thiazol-5-yl)methanol
CID 119087694
(2-chlorofuran-3-yl)-(1-propylimidazol-2-yl)methanamine
CID 106689402
(3S)-3-amino-3-(2-chlorofuran-3-yl)propanenitrile
CID 130713756

Frequently Asked Questions

What is the IUPAC name of (2-chlorofuran-3-yl)-(1,2-thiazol-5-yl)methanamine?
The IUPAC name of (2-chlorofuran-3-yl)-(1,2-thiazol-5-yl)methanamine (CID 131015361) is (2-chlorofuran-3-yl)-(1,2-thiazol-5-yl)methanamine.
What is the SMILES notation for (2-chlorofuran-3-yl)-(1,2-thiazol-5-yl)methanamine?
The canonical SMILES for (2-chlorofuran-3-yl)-(1,2-thiazol-5-yl)methanamine is NC(c1ccns1)c1ccoc1Cl.
What is the InChIKey of (2-chlorofuran-3-yl)-(1,2-thiazol-5-yl)methanamine?
The InChIKey is DNRKZQSEKYRHSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7ClN2OS/c9-8-5(2-4-12-8)7(10)6-1-3-11-13-6/h1-4,7H,10H2.
What are the key properties of (2-chlorofuran-3-yl)-(1,2-thiazol-5-yl)methanamine?
(2-chlorofuran-3-yl)-(1,2-thiazol-5-yl)methanamine has a molecular weight of 214.68 g/mol, XLogP of 2.44, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chlorofuran-3-yl)-(1,2-thiazol-5-yl)methanamine is sourced from PubChem (CID 131015361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).