N-(2-chlorophenyl)-4-pyridin-3-yl-1,3-thiazol-2-amine

C14H10ClN3S — CID 1092464

IUPACN-(2-chlorophenyl)-4-pyridin-3-yl-1,3-thiazol-2-amine
SMILESClc1ccccc1Nc1nc(-c2cccnc2)cs1
InChIInChI=1S/C14H10ClN3S/c15-11-5-1-2-6-12(11)17-14-18-13(9-19-14)10-4-3-7-16-8-10/h1-9H,(H,17,18)
InChIKeyLUWUGYXTIVKHKC-UHFFFAOYSA-N
MW287.78 g/mol
LogP4.60
Rot. Bonds3

About N-(2-chlorophenyl)-4-pyridin-3-yl-1,3-thiazol-2-amine

N-(2-chlorophenyl)-4-pyridin-3-yl-1,3-thiazol-2-amine (PubChem CID 1092464) has the molecular formula C14H10ClN3S and a molecular weight of 287.78 g/mol. Its IUPAC name is N-(2-chlorophenyl)-4-pyridin-3-yl-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-(2-chlorophenyl)-4-pyridin-3-yl-1,3-thiazol-2-amine
PubChem CID1092464
Molecular FormulaC14H10ClN3S
Molecular Weight287.78 g/mol
Exact Mass287.03
IUPAC NameN-(2-chlorophenyl)-4-pyridin-3-yl-1,3-thiazol-2-amine
SMILESClc1ccccc1Nc1nc(-c2cccnc2)cs1
InChIInChI=1S/C14H10ClN3S/c15-11-5-1-2-6-12(11)17-14-18-13(9-19-14)10-4-3-7-16-8-10/h1-9H,(H,17,18)
InChIKeyLUWUGYXTIVKHKC-UHFFFAOYSA-N
XLogP4.60
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.78
LogP ≤ 54.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-ethylphenyl)-4-pyridin-3-yl-1,3-thiazol-2-amine
CID 746667
N,4-dipyridin-3-yl-1,3-thiazol-2-amine
CID 2215784
1-(2-chlorophenyl)-3-[4-methyl-3-[(4-pyridin-3-yl-1,3-thiazol-2-yl)amino]phenyl]urea;1-(2-fluorophenyl)-3-[4-methyl-3-[(4-pyridin-3-yl-1,3-thiazol-2-yl)amino]phenyl]urea
CID 158018079
N-(2-chlorophenyl)-2-[(4-phenyl-1,3-thiazol-2-yl)amino]benzamide
CID 2295552
N-[2-methyl-3-(trifluoromethyl)phenyl]-4-pyridin-3-yl-1,3-thiazol-2-amine
CID 58791198
N-(6-phenyl-3-pyridinyl)-4-pyridin-3-yl-1,3-thiazol-2-amine
CID 58791761
N-[4-chloro-3-(trifluoromethyl)phenyl]-4-pyridin-3-yl-1,3-thiazol-2-amine
CID 58791500
N-(3,5-dimethylphenyl)-4-pyridin-3-yl-1,3-thiazol-2-amine
CID 58910456
3-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)-4-(trideuterio(113C)methyl)benzene-1,3-diamine
CID 91971706
N-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]-4-pyridin-3-yl-1,3-thiazol-2-amine
CID 58791509
N-tert-butyl-4-pyridin-3-yl-1,3-thiazol-2-amine
CID 62942552
N-(2-methoxy-5-phenoxyphenyl)-4-pyridin-3-yl-1,3-thiazol-2-amine
CID 58791567

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-4-pyridin-3-yl-1,3-thiazol-2-amine?
The IUPAC name of N-(2-chlorophenyl)-4-pyridin-3-yl-1,3-thiazol-2-amine (CID 1092464) is N-(2-chlorophenyl)-4-pyridin-3-yl-1,3-thiazol-2-amine.
What is the SMILES notation for N-(2-chlorophenyl)-4-pyridin-3-yl-1,3-thiazol-2-amine?
The canonical SMILES for N-(2-chlorophenyl)-4-pyridin-3-yl-1,3-thiazol-2-amine is Clc1ccccc1Nc1nc(-c2cccnc2)cs1.
What is the InChIKey of N-(2-chlorophenyl)-4-pyridin-3-yl-1,3-thiazol-2-amine?
The InChIKey is LUWUGYXTIVKHKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10ClN3S/c15-11-5-1-2-6-12(11)17-14-18-13(9-19-14)10-4-3-7-16-8-10/h1-9H,(H,17,18).
What are the key properties of N-(2-chlorophenyl)-4-pyridin-3-yl-1,3-thiazol-2-amine?
N-(2-chlorophenyl)-4-pyridin-3-yl-1,3-thiazol-2-amine has a molecular weight of 287.78 g/mol, XLogP of 4.60, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-4-pyridin-3-yl-1,3-thiazol-2-amine is sourced from PubChem (CID 1092464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).