2-methyl-N-[4-(6-methyl-5-phenylmethoxy-3-pyridinyl)-2-pyridinyl]pyrimidin-4-amine

C23H21N5O — CID 118249219

IUPAC2-methyl-N-[4-(6-methyl-5-phenylmethoxy-3-pyridinyl)-2-pyridinyl]pyrimidin-4-amine
SMILESCc1nccc(Nc2cc(-c3cnc(C)c(OCc4ccccc4)c3)ccn2)n1
InChIInChI=1S/C23H21N5O/c1-16-21(29-15-18-6-4-3-5-7-18)12-20(14-26-16)19-8-10-25-23(13-19)28-22-9-11-24-17(2)27-22/h3-14H,15H2,1-2H3,(H,24,25,27,28)
InChIKeyIZSHPZZOVRJMBU-UHFFFAOYSA-N
MW383.46 g/mol
LogP4.87
Rot. Bonds6

About 2-methyl-N-[4-(6-methyl-5-phenylmethoxy-3-pyridinyl)-2-pyridinyl]pyrimidin-4-amine

2-methyl-N-[4-(6-methyl-5-phenylmethoxy-3-pyridinyl)-2-pyridinyl]pyrimidin-4-amine (PubChem CID 118249219) has the molecular formula C23H21N5O and a molecular weight of 383.46 g/mol. Its IUPAC name is 2-methyl-N-[4-(6-methyl-5-phenylmethoxy-3-pyridinyl)-2-pyridinyl]pyrimidin-4-amine.

Molecular Properties

Compound Name2-methyl-N-[4-(6-methyl-5-phenylmethoxy-3-pyridinyl)-2-pyridinyl]pyrimidin-4-amine
PubChem CID118249219
Molecular FormulaC23H21N5O
Molecular Weight383.46 g/mol
Exact Mass383.17
IUPAC Name2-methyl-N-[4-(6-methyl-5-phenylmethoxy-3-pyridinyl)-2-pyridinyl]pyrimidin-4-amine
SMILESCc1nccc(Nc2cc(-c3cnc(C)c(OCc4ccccc4)c3)ccn2)n1
InChIInChI=1S/C23H21N5O/c1-16-21(29-15-18-6-4-3-5-7-18)12-20(14-26-16)19-8-10-25-23(13-19)28-22-9-11-24-17(2)27-22/h3-14H,15H2,1-2H3,(H,24,25,27,28)
InChIKeyIZSHPZZOVRJMBU-UHFFFAOYSA-N
XLogP4.87
TPSA72.82 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.46
LogP ≤ 54.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-methyl-N-[4-(6-methyl-5-phenylmethoxy-3-pyridinyl)-2-pyridinyl]pyrimidin-4-amine with MolForge

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Related Compounds

ethane;2-methyl-N-phenylpyrimidin-4-amine
CID 90727503
2-methyl-5-phenylmethoxypyrimidin-4-amine
CID 91812202
4-[(6-methyl-5-phenylmethoxy-3-pyridinyl)methylamino]benzonitrile
CID 143226328
4-methyl-N-[4-(3-phenylmethoxyphenoxy)-2-pyridinyl]-1,3-thiazol-2-amine
CID 24826501
3-methoxy-2-methyl-5-phenylpyridine
CID 133095590
2-fluoro-N-(3-phenylmethoxyphenyl)pyrimidin-4-amine
CID 164645110
4-N-(3-methylphenyl)-2-N-(4-phenylmethoxyphenyl)pyrimidine-2,4-diamine
CID 112901890
2-(4-methylpiperazin-1-yl)-N-(4-phenylmethoxyphenyl)pyrimidin-4-amine
CID 112888173
tert-butyl N-(6-methyl-5-phenylmethoxy-3-pyridinyl)carbamate
CID 166524697
2-methyl-5-[2-[(2-phenylmethoxyacetyl)amino]imidazo[1,2-b]pyridazin-6-yl]pyridine-3-carboxylic acid
CID 142580998
1-(2-methylpyrimidin-4-yl)-N-phenylmethoxymethanamine
CID 82710120
N-[4-[(4-methylnaphthalen-1-yl)oxymethyl]-2-pyridinyl]pyrazin-2-amine
CID 123408134

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[4-(6-methyl-5-phenylmethoxy-3-pyridinyl)-2-pyridinyl]pyrimidin-4-amine?
The IUPAC name of 2-methyl-N-[4-(6-methyl-5-phenylmethoxy-3-pyridinyl)-2-pyridinyl]pyrimidin-4-amine (CID 118249219) is 2-methyl-N-[4-(6-methyl-5-phenylmethoxy-3-pyridinyl)-2-pyridinyl]pyrimidin-4-amine.
What is the SMILES notation for 2-methyl-N-[4-(6-methyl-5-phenylmethoxy-3-pyridinyl)-2-pyridinyl]pyrimidin-4-amine?
The canonical SMILES for 2-methyl-N-[4-(6-methyl-5-phenylmethoxy-3-pyridinyl)-2-pyridinyl]pyrimidin-4-amine is Cc1nccc(Nc2cc(-c3cnc(C)c(OCc4ccccc4)c3)ccn2)n1.
What is the InChIKey of 2-methyl-N-[4-(6-methyl-5-phenylmethoxy-3-pyridinyl)-2-pyridinyl]pyrimidin-4-amine?
The InChIKey is IZSHPZZOVRJMBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N5O/c1-16-21(29-15-18-6-4-3-5-7-18)12-20(14-26-16)19-8-10-25-23(13-19)28-22-9-11-24-17(2)27-22/h3-14H,15H2,1-2H3,(H,24,25,27,28).
What are the key properties of 2-methyl-N-[4-(6-methyl-5-phenylmethoxy-3-pyridinyl)-2-pyridinyl]pyrimidin-4-amine?
2-methyl-N-[4-(6-methyl-5-phenylmethoxy-3-pyridinyl)-2-pyridinyl]pyrimidin-4-amine has a molecular weight of 383.46 g/mol, XLogP of 4.87, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[4-(6-methyl-5-phenylmethoxy-3-pyridinyl)-2-pyridinyl]pyrimidin-4-amine is sourced from PubChem (CID 118249219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).