8-ethyl-6-(4-fluorophenyl)-4-methyl-7H-pyrido[2,3-d]pyrimidin-2-amine

C16H17FN4 — CID 141182790

IUPAC8-ethyl-6-(4-fluorophenyl)-4-methyl-7H-pyrido[2,3-d]pyrimidin-2-amine
SMILESCCN1CC(c2ccc(F)cc2)=Cc2c(C)nc(N)nc21
InChIInChI=1S/C16H17FN4/c1-3-21-9-12(11-4-6-13(17)7-5-11)8-14-10(2)19-16(18)20-15(14)21/h4-8H,3,9H2,1-2H3,(H2,18,19,20)
InChIKeyCEGMYYFXEGNPIE-UHFFFAOYSA-N
MW284.34 g/mol
LogP2.89
Rot. Bonds2

About 8-ethyl-6-(4-fluorophenyl)-4-methyl-7H-pyrido[2,3-d]pyrimidin-2-amine

8-ethyl-6-(4-fluorophenyl)-4-methyl-7H-pyrido[2,3-d]pyrimidin-2-amine (PubChem CID 141182790) has the molecular formula C16H17FN4 and a molecular weight of 284.34 g/mol. Its IUPAC name is 8-ethyl-6-(4-fluorophenyl)-4-methyl-7H-pyrido[2,3-d]pyrimidin-2-amine.

Molecular Properties

Compound Name8-ethyl-6-(4-fluorophenyl)-4-methyl-7H-pyrido[2,3-d]pyrimidin-2-amine
PubChem CID141182790
Molecular FormulaC16H17FN4
Molecular Weight284.34 g/mol
Exact Mass284.14
IUPAC Name8-ethyl-6-(4-fluorophenyl)-4-methyl-7H-pyrido[2,3-d]pyrimidin-2-amine
SMILESCCN1CC(c2ccc(F)cc2)=Cc2c(C)nc(N)nc21
InChIInChI=1S/C16H17FN4/c1-3-21-9-12(11-4-6-13(17)7-5-11)8-14-10(2)19-16(18)20-15(14)21/h4-8H,3,9H2,1-2H3,(H2,18,19,20)
InChIKeyCEGMYYFXEGNPIE-UHFFFAOYSA-N
XLogP2.89
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.34
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Blonanserin
CID 125564
Diamino-5-phenyl-6-ethylpyrimidine, 2,4-
CID 93114
4,6-Diphenylpyrimidin-2-amine
CID 619024
Revaprazan
CID 204104
5-Phenyl-6-(3-phenylpropyl)pyrimidine-2,4-diamine
CID 9814965
2,4-Pyrimidinediamine, 6-hexyl-5-phenyl-
CID 9881905
6-Ethyl-5-(4-methylphenyl)pyrimidine-2,4-diamine
CID 11020649
4-(4-Methylpiperidin-1-Yl)-6-[4-(Trifluoromethyl)phenyl]pyrimidin-2-Amine
CID 75815440
6-Methyl-5-phenyl-2,4-pyrimidinediamine
CID 72565
4-Amino-2,6-diphenylpyrimidine
CID 619020
2-N-benzyl-4-N-butyl-6-methylpyrimidine-2,4-diamine
CID 659917
4-Amino-2,6-diphenylpyrimidine-5-carbonitrile
CID 2303947

Frequently Asked Questions

What is the IUPAC name of 8-ethyl-6-(4-fluorophenyl)-4-methyl-7H-pyrido[2,3-d]pyrimidin-2-amine?
The IUPAC name of 8-ethyl-6-(4-fluorophenyl)-4-methyl-7H-pyrido[2,3-d]pyrimidin-2-amine (CID 141182790) is 8-ethyl-6-(4-fluorophenyl)-4-methyl-7H-pyrido[2,3-d]pyrimidin-2-amine.
What is the SMILES notation for 8-ethyl-6-(4-fluorophenyl)-4-methyl-7H-pyrido[2,3-d]pyrimidin-2-amine?
The canonical SMILES for 8-ethyl-6-(4-fluorophenyl)-4-methyl-7H-pyrido[2,3-d]pyrimidin-2-amine is CCN1CC(c2ccc(F)cc2)=Cc2c(C)nc(N)nc21.
What is the InChIKey of 8-ethyl-6-(4-fluorophenyl)-4-methyl-7H-pyrido[2,3-d]pyrimidin-2-amine?
The InChIKey is CEGMYYFXEGNPIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FN4/c1-3-21-9-12(11-4-6-13(17)7-5-11)8-14-10(2)19-16(18)20-15(14)21/h4-8H,3,9H2,1-2H3,(H2,18,19,20).
What are the key properties of 8-ethyl-6-(4-fluorophenyl)-4-methyl-7H-pyrido[2,3-d]pyrimidin-2-amine?
8-ethyl-6-(4-fluorophenyl)-4-methyl-7H-pyrido[2,3-d]pyrimidin-2-amine has a molecular weight of 284.34 g/mol, XLogP of 2.89, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-ethyl-6-(4-fluorophenyl)-4-methyl-7H-pyrido[2,3-d]pyrimidin-2-amine is sourced from PubChem (CID 141182790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).