N-[(2-fluorophenyl)methyl]-N,5,6-trimethyl-2-pyridin-2-ylpyrimidin-4-amine

C19H19FN4 — CID 56584468

IUPACN-[(2-fluorophenyl)methyl]-N,5,6-trimethyl-2-pyridin-2-ylpyrimidin-4-amine
SMILESCc1nc(-c2ccccn2)nc(N(C)Cc2ccccc2F)c1C
InChIInChI=1S/C19H19FN4/c1-13-14(2)22-18(17-10-6-7-11-21-17)23-19(13)24(3)12-15-8-4-5-9-16(15)20/h4-11H,12H2,1-3H3
InChIKeyYPXDYPMSBQVGTB-UHFFFAOYSA-N
MW322.39 g/mol
LogP3.93
Rot. Bonds4

About N-[(2-fluorophenyl)methyl]-N,5,6-trimethyl-2-pyridin-2-ylpyrimidin-4-amine

N-[(2-fluorophenyl)methyl]-N,5,6-trimethyl-2-pyridin-2-ylpyrimidin-4-amine (PubChem CID 56584468) has the molecular formula C19H19FN4 and a molecular weight of 322.39 g/mol. Its IUPAC name is N-[(2-fluorophenyl)methyl]-N,5,6-trimethyl-2-pyridin-2-ylpyrimidin-4-amine.

Molecular Properties

Compound NameN-[(2-fluorophenyl)methyl]-N,5,6-trimethyl-2-pyridin-2-ylpyrimidin-4-amine
PubChem CID56584468
Molecular FormulaC19H19FN4
Molecular Weight322.39 g/mol
Exact Mass322.16
IUPAC NameN-[(2-fluorophenyl)methyl]-N,5,6-trimethyl-2-pyridin-2-ylpyrimidin-4-amine
SMILESCc1nc(-c2ccccn2)nc(N(C)Cc2ccccc2F)c1C
InChIInChI=1S/C19H19FN4/c1-13-14(2)22-18(17-10-6-7-11-21-17)23-19(13)24(3)12-15-8-4-5-9-16(15)20/h4-11H,12H2,1-3H3
InChIKeyYPXDYPMSBQVGTB-UHFFFAOYSA-N
XLogP3.93
TPSA41.91 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.39
LogP ≤ 53.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2-methoxyphenyl)methyl]-N,5,6-trimethyl-2-pyridin-2-ylpyrimidin-4-amine
CID 56584629
4-[[(5,6-dimethyl-2-pyridin-2-ylpyrimidin-4-yl)-methylamino]methyl]benzonitrile
CID 133290960
N-[(5-bromothiophen-3-yl)methyl]-N,5,6-trimethyl-2-pyridin-2-ylpyrimidin-4-amine
CID 56587593
N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-N,5,6-trimethyl-2-pyridin-2-ylpyrimidin-4-amine
CID 56584826
N,5,6-trimethyl-N-[2-(2-methylphenoxy)ethyl]-2-pyridin-2-ylpyrimidin-4-amine
CID 56563771
N-[(2-fluorophenyl)methyl]-N,5-dimethylpyrimidin-2-amine
CID 171701097
4-N-[(2-fluorophenyl)methyl]-4-N,6-N,2,5-tetramethylpyrimidine-4,6-diamine
CID 80794454
2-ethyl-4-N-[(2-fluorophenyl)methyl]-4-N,5-dimethylpyrimidine-4,6-diamine
CID 80987779
N,N-diethyl-5-[(2-fluorophenyl)methyl]-2-pyridin-2-ylpyrimidin-4-amine
CID 51042444
4,6-dichloro-5-[(2-fluorophenyl)methyl]-2-pyridin-2-ylpyrimidine
CID 86668904
5-(chloromethyl)-N-[(2-fluorophenyl)methyl]-N,4-dimethylpyrimidin-2-amine
CID 83184048
N-[(2-ethoxyphenyl)methyl]-N,5,6-trimethyl-2-pyridin-3-ylpyrimidin-4-amine
CID 133319393

Frequently Asked Questions

What is the IUPAC name of N-[(2-fluorophenyl)methyl]-N,5,6-trimethyl-2-pyridin-2-ylpyrimidin-4-amine?
The IUPAC name of N-[(2-fluorophenyl)methyl]-N,5,6-trimethyl-2-pyridin-2-ylpyrimidin-4-amine (CID 56584468) is N-[(2-fluorophenyl)methyl]-N,5,6-trimethyl-2-pyridin-2-ylpyrimidin-4-amine.
What is the SMILES notation for N-[(2-fluorophenyl)methyl]-N,5,6-trimethyl-2-pyridin-2-ylpyrimidin-4-amine?
The canonical SMILES for N-[(2-fluorophenyl)methyl]-N,5,6-trimethyl-2-pyridin-2-ylpyrimidin-4-amine is Cc1nc(-c2ccccn2)nc(N(C)Cc2ccccc2F)c1C.
What is the InChIKey of N-[(2-fluorophenyl)methyl]-N,5,6-trimethyl-2-pyridin-2-ylpyrimidin-4-amine?
The InChIKey is YPXDYPMSBQVGTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19FN4/c1-13-14(2)22-18(17-10-6-7-11-21-17)23-19(13)24(3)12-15-8-4-5-9-16(15)20/h4-11H,12H2,1-3H3.
What are the key properties of N-[(2-fluorophenyl)methyl]-N,5,6-trimethyl-2-pyridin-2-ylpyrimidin-4-amine?
N-[(2-fluorophenyl)methyl]-N,5,6-trimethyl-2-pyridin-2-ylpyrimidin-4-amine has a molecular weight of 322.39 g/mol, XLogP of 3.93, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-fluorophenyl)methyl]-N,5,6-trimethyl-2-pyridin-2-ylpyrimidin-4-amine is sourced from PubChem (CID 56584468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).