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

C19H21N5O — CID 136522931

IUPACN-[(2-methoxy-4,6-dimethyl-3-pyridinyl)methyl]-2-methyl-6-pyridin-3-ylpyrimidin-4-amine
SMILESCOc1nc(C)cc(C)c1CNc1cc(-c2cccnc2)nc(C)n1
InChIInChI=1S/C19H21N5O/c1-12-8-13(2)22-19(25-4)16(12)11-21-18-9-17(23-14(3)24-18)15-6-5-7-20-10-15/h5-10H,11H2,1-4H3,(H,21,23,24)
InChIKeyFPPIDVLMWVBPRX-UHFFFAOYSA-N
MW335.41 g/mol
LogP3.48
Rot. Bonds5

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

N-[(2-methoxy-4,6-dimethyl-3-pyridinyl)methyl]-2-methyl-6-pyridin-3-ylpyrimidin-4-amine (PubChem CID 136522931) has the molecular formula C19H21N5O and a molecular weight of 335.41 g/mol. Its IUPAC name is N-[(2-methoxy-4,6-dimethyl-3-pyridinyl)methyl]-2-methyl-6-pyridin-3-ylpyrimidin-4-amine.

Molecular Properties

Compound NameN-[(2-methoxy-4,6-dimethyl-3-pyridinyl)methyl]-2-methyl-6-pyridin-3-ylpyrimidin-4-amine
PubChem CID136522931
Molecular FormulaC19H21N5O
Molecular Weight335.41 g/mol
Exact Mass335.17
IUPAC NameN-[(2-methoxy-4,6-dimethyl-3-pyridinyl)methyl]-2-methyl-6-pyridin-3-ylpyrimidin-4-amine
SMILESCOc1nc(C)cc(C)c1CNc1cc(-c2cccnc2)nc(C)n1
InChIInChI=1S/C19H21N5O/c1-12-8-13(2)22-19(25-4)16(12)11-21-18-9-17(23-14(3)24-18)15-6-5-7-20-10-15/h5-10H,11H2,1-4H3,(H,21,23,24)
InChIKeyFPPIDVLMWVBPRX-UHFFFAOYSA-N
XLogP3.48
TPSA72.82 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.41
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[(2-methoxy-4,6-dimethyl-3-pyridinyl)methyl]-2-methyl-6-pyridin-3-ylpyrimidin-4-amine with MolForge

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Related Compounds

4-(4-methoxyphenyl)-2-methyl-6-pyridin-3-ylpyrimidine
CID 177437339
N-[(2-methoxy-4,6-dimethyl-3-pyridinyl)methyl]-4,5,6-trimethylpyrimidin-2-amine
CID 163311507
2-methyl-N-(3-morpholin-4-ylpropyl)-6-pyridin-3-ylpyrimidin-4-amine
CID 4998539
N-benzyl-2-methyl-6-phenylpyrimidin-4-amine
CID 16957885
N,2-diethyl-6-pyridin-3-ylpyrimidin-4-amine
CID 78990312
4-N-(2-methoxyphenyl)-2-methyl-6-N-(pyridin-3-ylmethyl)pyrimidine-4,6-diamine
CID 112873455
4-[(2-methyl-6-pyridin-3-ylpyrimidin-4-yl)amino]benzoic acid
CID 56767917
6-ethyl-2-methyl-N-(pyridin-3-ylmethyl)pyrimidin-4-amine
CID 65418872
N-(2,2-dimethoxyethyl)-6-pyridin-3-yl-2-pyridin-4-ylpyrimidin-4-amine
CID 3282641
2-methyl-6-N-pentyl-4-N-(pyridin-3-ylmethyl)pyrimidine-4,6-diamine
CID 112873406
3-[(2-methyl-6-pyridin-3-ylpyrimidin-4-yl)amino]benzoic acid
CID 56767987
3-[[6-[5-(4-methoxyphenyl)-3-pyridinyl]-2-methylpyrimidin-4-yl]amino]propanenitrile
CID 3701721

Frequently Asked Questions

What is the IUPAC name of N-[(2-methoxy-4,6-dimethyl-3-pyridinyl)methyl]-2-methyl-6-pyridin-3-ylpyrimidin-4-amine?
The IUPAC name of N-[(2-methoxy-4,6-dimethyl-3-pyridinyl)methyl]-2-methyl-6-pyridin-3-ylpyrimidin-4-amine (CID 136522931) is N-[(2-methoxy-4,6-dimethyl-3-pyridinyl)methyl]-2-methyl-6-pyridin-3-ylpyrimidin-4-amine.
What is the SMILES notation for N-[(2-methoxy-4,6-dimethyl-3-pyridinyl)methyl]-2-methyl-6-pyridin-3-ylpyrimidin-4-amine?
The canonical SMILES for N-[(2-methoxy-4,6-dimethyl-3-pyridinyl)methyl]-2-methyl-6-pyridin-3-ylpyrimidin-4-amine is COc1nc(C)cc(C)c1CNc1cc(-c2cccnc2)nc(C)n1.
What is the InChIKey of N-[(2-methoxy-4,6-dimethyl-3-pyridinyl)methyl]-2-methyl-6-pyridin-3-ylpyrimidin-4-amine?
The InChIKey is FPPIDVLMWVBPRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5O/c1-12-8-13(2)22-19(25-4)16(12)11-21-18-9-17(23-14(3)24-18)15-6-5-7-20-10-15/h5-10H,11H2,1-4H3,(H,21,23,24).
What are the key properties of N-[(2-methoxy-4,6-dimethyl-3-pyridinyl)methyl]-2-methyl-6-pyridin-3-ylpyrimidin-4-amine?
N-[(2-methoxy-4,6-dimethyl-3-pyridinyl)methyl]-2-methyl-6-pyridin-3-ylpyrimidin-4-amine has a molecular weight of 335.41 g/mol, XLogP of 3.48, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methoxy-4,6-dimethyl-3-pyridinyl)methyl]-2-methyl-6-pyridin-3-ylpyrimidin-4-amine is sourced from PubChem (CID 136522931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).