N-[4-chloro-3-(furan-2-ylmethoxy)phenyl]-1,3-thiazol-2-amine

C14H11ClN2O2S — CID 15956098

IUPACN-[4-chloro-3-(furan-2-ylmethoxy)phenyl]-1,3-thiazol-2-amine
SMILESClc1ccc(Nc2nccs2)cc1OCc1ccco1
InChIInChI=1S/C14H11ClN2O2S/c15-12-4-3-10(17-14-16-5-7-20-14)8-13(12)19-9-11-2-1-6-18-11/h1-8H,9H2,(H,16,17)
InChIKeyGJXXAJXDSXQMMA-UHFFFAOYSA-N
MW306.77 g/mol
LogP4.71
Rot. Bonds5

About N-[4-chloro-3-(furan-2-ylmethoxy)phenyl]-1,3-thiazol-2-amine

N-[4-chloro-3-(furan-2-ylmethoxy)phenyl]-1,3-thiazol-2-amine (PubChem CID 15956098) has the molecular formula C14H11ClN2O2S and a molecular weight of 306.77 g/mol. Its IUPAC name is N-[4-chloro-3-(furan-2-ylmethoxy)phenyl]-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-[4-chloro-3-(furan-2-ylmethoxy)phenyl]-1,3-thiazol-2-amine
PubChem CID15956098
Molecular FormulaC14H11ClN2O2S
Molecular Weight306.77 g/mol
Exact Mass306.02
IUPAC NameN-[4-chloro-3-(furan-2-ylmethoxy)phenyl]-1,3-thiazol-2-amine
SMILESClc1ccc(Nc2nccs2)cc1OCc1ccco1
InChIInChI=1S/C14H11ClN2O2S/c15-12-4-3-10(17-14-16-5-7-20-14)8-13(12)19-9-11-2-1-6-18-11/h1-8H,9H2,(H,16,17)
InChIKeyGJXXAJXDSXQMMA-UHFFFAOYSA-N
XLogP4.71
TPSA47.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.77
LogP ≤ 54.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-[(2-chlorophenoxy)methyl]-N-(2-thiazolyl)-2-furancarboxamide
CID 903491
N-[4-chloro-3-(3-methylbut-2-enoxy)phenyl]thiazol-2-amine
CID 15956092
N-[4-chloro-3-[(Z)-3-methylpent-2-enoxy]phenyl]thiazol-2-amine
CID 15956109
2-(2-Furylmethoxy)-4-(thiazol-2-ylamino)benzonitrile
CID 15956099
N-[4-chloro-3-(3-furylmethoxy)phenyl]thiazol-2-amine
CID 15956100
N-[4-chloro-3-(3-thienylmethoxy)phenyl]thiazol-2-amine
CID 15956104
N-[4-chloro-3-(2-thienylmethoxy)phenyl]thiazol-2-amine
CID 15956102
N-[4-chloro-3-(cyclopenten-1-ylmethoxy)phenyl]thiazol-2-amine
CID 15956110
N-(4-chloro-3-(thiazol-2-ylmethoxy)phenyl)thiazol-2-amine
CID 15956106
N-(3-(Furan-2-ylmethoxy)-4-methylphenyl)thiazol-2-amine
CID 86645041
N-(4-Chloro-3-(4-methylpent-3-en-2-yloxy)phenyl)thiazol-2-amine
CID 86645046
N-(4-Chloro-3-(cyclopentenyloxy)phenyl)thiazol-2-amine
CID 86645047

Frequently Asked Questions

What is the IUPAC name of N-[4-chloro-3-(furan-2-ylmethoxy)phenyl]-1,3-thiazol-2-amine?
The IUPAC name of N-[4-chloro-3-(furan-2-ylmethoxy)phenyl]-1,3-thiazol-2-amine (CID 15956098) is N-[4-chloro-3-(furan-2-ylmethoxy)phenyl]-1,3-thiazol-2-amine.
What is the SMILES notation for N-[4-chloro-3-(furan-2-ylmethoxy)phenyl]-1,3-thiazol-2-amine?
The canonical SMILES for N-[4-chloro-3-(furan-2-ylmethoxy)phenyl]-1,3-thiazol-2-amine is Clc1ccc(Nc2nccs2)cc1OCc1ccco1.
What is the InChIKey of N-[4-chloro-3-(furan-2-ylmethoxy)phenyl]-1,3-thiazol-2-amine?
The InChIKey is GJXXAJXDSXQMMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClN2O2S/c15-12-4-3-10(17-14-16-5-7-20-14)8-13(12)19-9-11-2-1-6-18-11/h1-8H,9H2,(H,16,17).
What are the key properties of N-[4-chloro-3-(furan-2-ylmethoxy)phenyl]-1,3-thiazol-2-amine?
N-[4-chloro-3-(furan-2-ylmethoxy)phenyl]-1,3-thiazol-2-amine has a molecular weight of 306.77 g/mol, XLogP of 4.71, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-chloro-3-(furan-2-ylmethoxy)phenyl]-1,3-thiazol-2-amine is sourced from PubChem (CID 15956098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).