N-[2-[4-[(6-fluoro-2-pyridinyl)oxy]phenyl]ethyl]pteridin-4-amine

C19H15FN6O — CID 58174220

IUPACN-[2-[4-[(6-fluoro-2-pyridinyl)oxy]phenyl]ethyl]pteridin-4-amine
SMILESFc1cccc(Oc2ccc(CCNc3ncnc4nccnc34)cc2)n1
InChIInChI=1S/C19H15FN6O/c20-15-2-1-3-16(26-15)27-14-6-4-13(5-7-14)8-9-22-18-17-19(25-12-24-18)23-11-10-21-17/h1-7,10-12H,8-9H2,(H,22,23,24,25)
InChIKeyAWEKQGUMYSJXJX-UHFFFAOYSA-N
MW362.37 g/mol
LogP3.40
Rot. Bonds6

About N-[2-[4-[(6-fluoro-2-pyridinyl)oxy]phenyl]ethyl]pteridin-4-amine

N-[2-[4-[(6-fluoro-2-pyridinyl)oxy]phenyl]ethyl]pteridin-4-amine (PubChem CID 58174220) has the molecular formula C19H15FN6O and a molecular weight of 362.37 g/mol. Its IUPAC name is N-[2-[4-[(6-fluoro-2-pyridinyl)oxy]phenyl]ethyl]pteridin-4-amine.

Molecular Properties

Compound NameN-[2-[4-[(6-fluoro-2-pyridinyl)oxy]phenyl]ethyl]pteridin-4-amine
PubChem CID58174220
Molecular FormulaC19H15FN6O
Molecular Weight362.37 g/mol
Exact Mass362.13
IUPAC NameN-[2-[4-[(6-fluoro-2-pyridinyl)oxy]phenyl]ethyl]pteridin-4-amine
SMILESFc1cccc(Oc2ccc(CCNc3ncnc4nccnc34)cc2)n1
InChIInChI=1S/C19H15FN6O/c20-15-2-1-3-16(26-15)27-14-6-4-13(5-7-14)8-9-22-18-17-19(25-12-24-18)23-11-10-21-17/h1-7,10-12H,8-9H2,(H,22,23,24,25)
InChIKeyAWEKQGUMYSJXJX-UHFFFAOYSA-N
XLogP3.40
TPSA85.71 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.37
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

N-[2-(4-methoxyphenyl)ethyl]pteridin-4-amine
CID 58174186
N-[2-[4-[(3,5,6-trifluoro-2-pyridinyl)oxy]phenyl]ethyl]pteridin-4-amine
CID 58174056
N-[2-[4-[[4-(1,1-difluoroethyl)-6-methoxy-2-pyridinyl]oxy]phenyl]ethyl]pteridin-4-amine
CID 51000642
N-[2-[4-[(3-methoxy-1,2,4-thiadiazol-5-yl)oxy]phenyl]ethyl]pteridin-4-amine
CID 58174143
N-[2-(4-phenylphenyl)ethyl]pteridin-4-amine
CID 58174286
N-[2-[4-[[2-chloro-4-(trifluoromethyl)-3-pyridinyl]oxy]phenyl]ethyl]pteridin-4-amine
CID 58174236
N-[2-[3-[(4-iodo-2-pyridinyl)oxy]phenyl]ethyl]pteridin-4-amine
CID 58174149
N-[2-[4-[2-(4-phenylmethoxyphenyl)ethoxy]phenyl]ethyl]pteridin-4-amine;4-[2-(pteridin-4-ylamino)ethyl]phenol
CID 161366630
2-[4-[(6-fluoro-2-pyridinyl)oxy]phenyl]ethanol
CID 107708756
N-[2-[4-[[4-(1,1-difluoroethyl)-6-methoxy-2-pyridinyl]oxy]phenyl]ethyl]pteridin-4-amine;N-[2-[4-[4-(1,1-difluoroethyl)-1-oxidopyridin-1-ium-2-yl]oxyphenyl]ethyl]pteridin-4-amine
CID 159535284
N-[2-(3-bromo-4-methoxyphenyl)ethyl]pteridin-4-amine
CID 58174262
2-methyl-4-[2-(pteridin-4-ylamino)ethyl]phenol
CID 58174107

Frequently Asked Questions

What is the IUPAC name of N-[2-[4-[(6-fluoro-2-pyridinyl)oxy]phenyl]ethyl]pteridin-4-amine?
The IUPAC name of N-[2-[4-[(6-fluoro-2-pyridinyl)oxy]phenyl]ethyl]pteridin-4-amine (CID 58174220) is N-[2-[4-[(6-fluoro-2-pyridinyl)oxy]phenyl]ethyl]pteridin-4-amine.
What is the SMILES notation for N-[2-[4-[(6-fluoro-2-pyridinyl)oxy]phenyl]ethyl]pteridin-4-amine?
The canonical SMILES for N-[2-[4-[(6-fluoro-2-pyridinyl)oxy]phenyl]ethyl]pteridin-4-amine is Fc1cccc(Oc2ccc(CCNc3ncnc4nccnc34)cc2)n1.
What is the InChIKey of N-[2-[4-[(6-fluoro-2-pyridinyl)oxy]phenyl]ethyl]pteridin-4-amine?
The InChIKey is AWEKQGUMYSJXJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15FN6O/c20-15-2-1-3-16(26-15)27-14-6-4-13(5-7-14)8-9-22-18-17-19(25-12-24-18)23-11-10-21-17/h1-7,10-12H,8-9H2,(H,22,23,24,25).
What are the key properties of N-[2-[4-[(6-fluoro-2-pyridinyl)oxy]phenyl]ethyl]pteridin-4-amine?
N-[2-[4-[(6-fluoro-2-pyridinyl)oxy]phenyl]ethyl]pteridin-4-amine has a molecular weight of 362.37 g/mol, XLogP of 3.40, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[4-[(6-fluoro-2-pyridinyl)oxy]phenyl]ethyl]pteridin-4-amine is sourced from PubChem (CID 58174220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).