6-(4-fluorophenyl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrido[2,3-d]pyrimidin-4-amine

C18H14FN5S — CID 155339420

IUPAC6-(4-fluorophenyl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrido[2,3-d]pyrimidin-4-amine
SMILESCc1nc(CNc2ncnc3ncc(-c4ccc(F)cc4)cc23)cs1
InChIInChI=1S/C18H14FN5S/c1-11-24-15(9-25-11)8-21-18-16-6-13(7-20-17(16)22-10-23-18)12-2-4-14(19)5-3-12/h2-7,9-10H,8H2,1H3,(H,20,21,22,23)
InChIKeyVLWMUYSAYAHUBQ-UHFFFAOYSA-N
MW351.41 g/mol
LogP4.21
Rot. Bonds4

About 6-(4-fluorophenyl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrido[2,3-d]pyrimidin-4-amine

6-(4-fluorophenyl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrido[2,3-d]pyrimidin-4-amine (PubChem CID 155339420) has the molecular formula C18H14FN5S and a molecular weight of 351.41 g/mol. Its IUPAC name is 6-(4-fluorophenyl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrido[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name6-(4-fluorophenyl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrido[2,3-d]pyrimidin-4-amine
PubChem CID155339420
Molecular FormulaC18H14FN5S
Molecular Weight351.41 g/mol
Exact Mass351.10
IUPAC Name6-(4-fluorophenyl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrido[2,3-d]pyrimidin-4-amine
SMILESCc1nc(CNc2ncnc3ncc(-c4ccc(F)cc4)cc23)cs1
InChIInChI=1S/C18H14FN5S/c1-11-24-15(9-25-11)8-21-18-16-6-13(7-20-17(16)22-10-23-18)12-2-4-14(19)5-3-12/h2-7,9-10H,8H2,1H3,(H,20,21,22,23)
InChIKeyVLWMUYSAYAHUBQ-UHFFFAOYSA-N
XLogP4.21
TPSA63.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.41
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 6-(4-fluorophenyl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrido[2,3-d]pyrimidin-4-amine with MolForge

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Related Compounds

[5-[4-[(2-methyl-1,3-thiazol-4-yl)methylamino]quinazolin-6-yl]furan-2-yl]methanol
CID 44968229
N-[(2-methyl-1,3-thiazol-4-yl)methyl]-[1,3]dioxolo[4,5-g]isoquinolin-5-amine
CID 106537932
6-N-ethyl-4-N-[(2-methyl-1,3-thiazol-4-yl)methyl]-5-propylpyrimidine-4,6-diamine
CID 80807042
2-[[6-(4-fluorophenyl)pyrido[2,3-d]pyrimidin-4-yl]amino]-2-(5-methyl-1,2,4-oxadiazol-3-yl)ethanol
CID 155339418
ethyl 5-[4-[(2-methyl-1,3-thiazol-4-yl)methylamino]quinazolin-6-yl]furan-2-carboxylate
CID 44968259
6-hydrazinyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]-5-propan-2-ylpyrimidin-4-amine
CID 80897968
3,6-dimethyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrazin-2-amine
CID 65416461
6-methyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrimidin-4-amine
CID 61283435
6-(4-fluorophenyl)-4-[(6-methylpyridazin-3-yl)methylamino]quinazolin-8-ol
CID 155339950
6-chloro-N-[(2-methyl-1,3-thiazol-4-yl)methyl]-5-propan-2-ylpyrimidin-4-amine
CID 63729301
7-methoxy-N-[(2-methyl-1,3-thiazol-4-yl)methyl]isoquinolin-1-amine
CID 106537936
6-N-methyl-4-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrimidine-4,6-diamine
CID 80808044

Frequently Asked Questions

What is the IUPAC name of 6-(4-fluorophenyl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrido[2,3-d]pyrimidin-4-amine?
The IUPAC name of 6-(4-fluorophenyl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrido[2,3-d]pyrimidin-4-amine (CID 155339420) is 6-(4-fluorophenyl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrido[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 6-(4-fluorophenyl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrido[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 6-(4-fluorophenyl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrido[2,3-d]pyrimidin-4-amine is Cc1nc(CNc2ncnc3ncc(-c4ccc(F)cc4)cc23)cs1.
What is the InChIKey of 6-(4-fluorophenyl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrido[2,3-d]pyrimidin-4-amine?
The InChIKey is VLWMUYSAYAHUBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14FN5S/c1-11-24-15(9-25-11)8-21-18-16-6-13(7-20-17(16)22-10-23-18)12-2-4-14(19)5-3-12/h2-7,9-10H,8H2,1H3,(H,20,21,22,23).
What are the key properties of 6-(4-fluorophenyl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrido[2,3-d]pyrimidin-4-amine?
6-(4-fluorophenyl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrido[2,3-d]pyrimidin-4-amine has a molecular weight of 351.41 g/mol, XLogP of 4.21, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-fluorophenyl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrido[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 155339420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).