6-[[(2-methoxyphenyl)methylamino]methyl]-N,N-dimethyl-2-pyridin-3-ylpyrimidin-4-amine

C20H23N5O — CID 92606982

IUPAC6-[[(2-methoxyphenyl)methylamino]methyl]-N,N-dimethyl-2-pyridin-3-ylpyrimidin-4-amine
SMILESCOc1ccccc1CNCc1cc(N(C)C)nc(-c2cccnc2)n1
InChIInChI=1S/C20H23N5O/c1-25(2)19-11-17(23-20(24-19)16-8-6-10-21-13-16)14-22-12-15-7-4-5-9-18(15)26-3/h4-11,13,22H,12,14H2,1-3H3
InChIKeyZCPXGPVDPAUSSJ-UHFFFAOYSA-N
MW349.44 g/mol
LogP2.90
Rot. Bonds7

About 6-[[(2-methoxyphenyl)methylamino]methyl]-N,N-dimethyl-2-pyridin-3-ylpyrimidin-4-amine

6-[[(2-methoxyphenyl)methylamino]methyl]-N,N-dimethyl-2-pyridin-3-ylpyrimidin-4-amine (PubChem CID 92606982) has the molecular formula C20H23N5O and a molecular weight of 349.44 g/mol. Its IUPAC name is 6-[[(2-methoxyphenyl)methylamino]methyl]-N,N-dimethyl-2-pyridin-3-ylpyrimidin-4-amine.

Molecular Properties

Compound Name6-[[(2-methoxyphenyl)methylamino]methyl]-N,N-dimethyl-2-pyridin-3-ylpyrimidin-4-amine
PubChem CID92606982
Molecular FormulaC20H23N5O
Molecular Weight349.44 g/mol
Exact Mass349.19
IUPAC Name6-[[(2-methoxyphenyl)methylamino]methyl]-N,N-dimethyl-2-pyridin-3-ylpyrimidin-4-amine
SMILESCOc1ccccc1CNCc1cc(N(C)C)nc(-c2cccnc2)n1
InChIInChI=1S/C20H23N5O/c1-25(2)19-11-17(23-20(24-19)16-8-6-10-21-13-16)14-22-12-15-7-4-5-9-18(15)26-3/h4-11,13,22H,12,14H2,1-3H3
InChIKeyZCPXGPVDPAUSSJ-UHFFFAOYSA-N
XLogP2.90
TPSA63.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.44
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[(2-methoxyphenyl)methyl]-2-pyridin-3-yl-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-4-amine
CID 56898791
1-(2-methoxyphenyl)-N-[(1-methyl-3-pyridin-3-ylpyrazol-4-yl)methyl]methanamine
CID 47610180
6-(3-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]-2-pyridin-3-ylquinazolin-4-amine
CID 71180587
N-[(2-methoxyphenyl)methyl]-1-pyridin-3-ylmethanamine;oxalic acid
CID 17367682
1-[4-[6-(dimethylamino)-2-pyridin-3-ylpyrimidin-4-yl]piperidin-1-yl]-2-(2-methoxy-5-methylphenyl)ethanone
CID 92556138
6-[(3R)-1-[[3-[(dimethylamino)methyl]-4-methoxyphenyl]methyl]piperidin-3-yl]-N,N-dimethyl-2-pyridin-3-ylpyrimidin-4-amine
CID 124960098
N-[[4-[(dimethylamino)methyl]-2-methoxyphenyl]methyl]-1-pyridin-3-ylmethanamine
CID 84746205
N-[(6-methyl-2-pyridin-3-ylpyrimidin-4-yl)methyl]propan-1-amine
CID 62744815
6-[(3R)-1-[[2-methoxy-5-(methoxymethyl)phenyl]methyl]piperidin-3-yl]-N,N-dimethyl-2-pyridin-3-ylpyrimidin-4-amine
CID 92606924
N-[(2-methoxyphenyl)methyl]-5-(methylamino)-2-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carboxamide
CID 142146777
(2,6-dimethoxyphenyl)-[3-[6-(dimethylamino)-2-pyridin-3-ylpyrimidin-4-yl]piperidin-1-yl]methanone
CID 110239961
2-(2-methoxyphenyl)-N-[(5-pyridin-3-yl-3-pyridinyl)methyl]acetamide
CID 131702715

Frequently Asked Questions

What is the IUPAC name of 6-[[(2-methoxyphenyl)methylamino]methyl]-N,N-dimethyl-2-pyridin-3-ylpyrimidin-4-amine?
The IUPAC name of 6-[[(2-methoxyphenyl)methylamino]methyl]-N,N-dimethyl-2-pyridin-3-ylpyrimidin-4-amine (CID 92606982) is 6-[[(2-methoxyphenyl)methylamino]methyl]-N,N-dimethyl-2-pyridin-3-ylpyrimidin-4-amine.
What is the SMILES notation for 6-[[(2-methoxyphenyl)methylamino]methyl]-N,N-dimethyl-2-pyridin-3-ylpyrimidin-4-amine?
The canonical SMILES for 6-[[(2-methoxyphenyl)methylamino]methyl]-N,N-dimethyl-2-pyridin-3-ylpyrimidin-4-amine is COc1ccccc1CNCc1cc(N(C)C)nc(-c2cccnc2)n1.
What is the InChIKey of 6-[[(2-methoxyphenyl)methylamino]methyl]-N,N-dimethyl-2-pyridin-3-ylpyrimidin-4-amine?
The InChIKey is ZCPXGPVDPAUSSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N5O/c1-25(2)19-11-17(23-20(24-19)16-8-6-10-21-13-16)14-22-12-15-7-4-5-9-18(15)26-3/h4-11,13,22H,12,14H2,1-3H3.
What are the key properties of 6-[[(2-methoxyphenyl)methylamino]methyl]-N,N-dimethyl-2-pyridin-3-ylpyrimidin-4-amine?
6-[[(2-methoxyphenyl)methylamino]methyl]-N,N-dimethyl-2-pyridin-3-ylpyrimidin-4-amine has a molecular weight of 349.44 g/mol, XLogP of 2.90, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[(2-methoxyphenyl)methylamino]methyl]-N,N-dimethyl-2-pyridin-3-ylpyrimidin-4-amine is sourced from PubChem (CID 92606982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).