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

C14H12N4S — CID 1092469

IUPACN-(3-methyl-2-pyridinyl)-4-pyridin-4-yl-1,3-thiazol-2-amine
SMILESCc1cccnc1Nc1nc(-c2ccncc2)cs1
InChIInChI=1S/C14H12N4S/c1-10-3-2-6-16-13(10)18-14-17-12(9-19-14)11-4-7-15-8-5-11/h2-9H,1H3,(H,16,17,18)
InChIKeyDAHDSOFNKLALLL-UHFFFAOYSA-N
MW268.35 g/mol
LogP3.65
Rot. Bonds3

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

N-(3-methyl-2-pyridinyl)-4-pyridin-4-yl-1,3-thiazol-2-amine (PubChem CID 1092469) has the molecular formula C14H12N4S and a molecular weight of 268.35 g/mol. Its IUPAC name is N-(3-methyl-2-pyridinyl)-4-pyridin-4-yl-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-(3-methyl-2-pyridinyl)-4-pyridin-4-yl-1,3-thiazol-2-amine
PubChem CID1092469
Molecular FormulaC14H12N4S
Molecular Weight268.35 g/mol
Exact Mass268.08
IUPAC NameN-(3-methyl-2-pyridinyl)-4-pyridin-4-yl-1,3-thiazol-2-amine
SMILESCc1cccnc1Nc1nc(-c2ccncc2)cs1
InChIInChI=1S/C14H12N4S/c1-10-3-2-6-16-13(10)18-14-17-12(9-19-14)11-4-7-15-8-5-11/h2-9H,1H3,(H,16,17,18)
InChIKeyDAHDSOFNKLALLL-UHFFFAOYSA-N
XLogP3.65
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.35
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'thiazole_amine_M(1)', 'substructure': 'N/A'}

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Related Compounds

4-(4-chlorophenyl)-N-(3-methyl-2-pyridinyl)-1,3-thiazol-2-amine
CID 2215267
4-(furan-3-yl)-N-(3-methyl-2-pyridinyl)-1,3-thiazol-2-amine;hydrochloride
CID 72720208
4-(5-chloro-2-pyridinyl)-N-(3-methyl-2-pyridinyl)-1,3-thiazol-2-amine
CID 170674867
4-(4,5-dimethoxy-2-pyridinyl)-N-(3-methyl-2-pyridinyl)-1,3-thiazol-2-amine
CID 163269056
4-methyl-3-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)benzene-1,3-diamine
CID 82059283
N-(3-chloro-4-methylphenyl)-4-pyridin-4-yl-1,3-thiazol-2-amine
CID 2214320
1-[4-[2-[(3-methyl-2-pyridinyl)amino]-1,3-thiazol-4-yl]piperidin-1-yl]ethanone
CID 95828285
4-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)benzene-1,4-diamine bromide
CID 53346790
N-(4-fluorophenyl)-4-pyridin-4-yl-1,3-thiazol-2-amine;hydrochloride
CID 163328871
N-(3-methylsulfanylphenyl)-4-pyridin-4-yl-1,3-thiazol-2-amine
CID 58910606
2-methyl-3-[(4-pyridin-4-yl-1,3-thiazol-2-yl)amino]benzamide
CID 141123181
N-[4-[(4-pyridin-4-yl-1,3-thiazol-2-yl)amino]phenyl]methanesulfonamide
CID 110504077

Frequently Asked Questions

What is the IUPAC name of N-(3-methyl-2-pyridinyl)-4-pyridin-4-yl-1,3-thiazol-2-amine?
The IUPAC name of N-(3-methyl-2-pyridinyl)-4-pyridin-4-yl-1,3-thiazol-2-amine (CID 1092469) is N-(3-methyl-2-pyridinyl)-4-pyridin-4-yl-1,3-thiazol-2-amine.
What is the SMILES notation for N-(3-methyl-2-pyridinyl)-4-pyridin-4-yl-1,3-thiazol-2-amine?
The canonical SMILES for N-(3-methyl-2-pyridinyl)-4-pyridin-4-yl-1,3-thiazol-2-amine is Cc1cccnc1Nc1nc(-c2ccncc2)cs1.
What is the InChIKey of N-(3-methyl-2-pyridinyl)-4-pyridin-4-yl-1,3-thiazol-2-amine?
The InChIKey is DAHDSOFNKLALLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N4S/c1-10-3-2-6-16-13(10)18-14-17-12(9-19-14)11-4-7-15-8-5-11/h2-9H,1H3,(H,16,17,18).
What are the key properties of N-(3-methyl-2-pyridinyl)-4-pyridin-4-yl-1,3-thiazol-2-amine?
N-(3-methyl-2-pyridinyl)-4-pyridin-4-yl-1,3-thiazol-2-amine has a molecular weight of 268.35 g/mol, XLogP of 3.65, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methyl-2-pyridinyl)-4-pyridin-4-yl-1,3-thiazol-2-amine is sourced from PubChem (CID 1092469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).