N,2-diethyl-6-(2-methylphenyl)pyrimidin-4-amine

C15H19N3 — CID 80935861

IUPACN,2-diethyl-6-(2-methylphenyl)pyrimidin-4-amine
SMILESCCNc1cc(-c2ccccc2C)nc(CC)n1
InChIInChI=1S/C15H19N3/c1-4-14-17-13(10-15(18-14)16-5-2)12-9-7-6-8-11(12)3/h6-10H,4-5H2,1-3H3,(H,16,17,18)
InChIKeyXBCKDQQRFSLTAB-UHFFFAOYSA-N
MW241.34 g/mol
LogP3.45
Rot. Bonds4

About N,2-diethyl-6-(2-methylphenyl)pyrimidin-4-amine

N,2-diethyl-6-(2-methylphenyl)pyrimidin-4-amine (PubChem CID 80935861) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is N,2-diethyl-6-(2-methylphenyl)pyrimidin-4-amine.

Molecular Properties

Compound NameN,2-diethyl-6-(2-methylphenyl)pyrimidin-4-amine
PubChem CID80935861
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC NameN,2-diethyl-6-(2-methylphenyl)pyrimidin-4-amine
SMILESCCNc1cc(-c2ccccc2C)nc(CC)n1
InChIInChI=1S/C15H19N3/c1-4-14-17-13(10-15(18-14)16-5-2)12-9-7-6-8-11(12)3/h6-10H,4-5H2,1-3H3,(H,16,17,18)
InChIKeyXBCKDQQRFSLTAB-UHFFFAOYSA-N
XLogP3.45
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,2-diethyl-6-(3-methyl-4-pyridinyl)pyrimidin-4-amine
CID 80935529
N-ethyl-6-(2-methylphenyl)-4-(trifluoromethyl)pyridin-2-amine
CID 102716549
6-(2,5-difluorophenyl)-N,2-diethylpyrimidin-4-amine
CID 80936764
2-ethyl-6-(2-fluorophenyl)-N-propylpyrimidin-4-amine
CID 80936849
N,2-diethyl-6-(3-fluorophenyl)pyrimidin-4-amine
CID 80936579
N,2-diethyl-6-pyridin-3-ylpyrimidin-4-amine
CID 78990312
N,2-diethyl-6-quinolin-3-ylpyrimidin-4-amine
CID 80938836
2-ethyl-N-methyl-6-naphthalen-1-ylpyrimidin-4-amine
CID 80936663
2-ethyl-6-(4-methoxy-2-methylphenyl)-N-propylpyrimidin-4-amine
CID 80939033
4-N-(2,3-dihydro-1H-inden-2-yl)-6-N,2-diethylpyrimidine-4,6-diamine
CID 107855395
N,2-diethyl-6-(4-propan-2-ylphenyl)pyrimidin-4-amine
CID 80936235
2-ethyl-N-methyl-6-(4-methyl-3-pyridinyl)pyrimidin-4-amine
CID 80935966

Frequently Asked Questions

What is the IUPAC name of N,2-diethyl-6-(2-methylphenyl)pyrimidin-4-amine?
The IUPAC name of N,2-diethyl-6-(2-methylphenyl)pyrimidin-4-amine (CID 80935861) is N,2-diethyl-6-(2-methylphenyl)pyrimidin-4-amine.
What is the SMILES notation for N,2-diethyl-6-(2-methylphenyl)pyrimidin-4-amine?
The canonical SMILES for N,2-diethyl-6-(2-methylphenyl)pyrimidin-4-amine is CCNc1cc(-c2ccccc2C)nc(CC)n1.
What is the InChIKey of N,2-diethyl-6-(2-methylphenyl)pyrimidin-4-amine?
The InChIKey is XBCKDQQRFSLTAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-4-14-17-13(10-15(18-14)16-5-2)12-9-7-6-8-11(12)3/h6-10H,4-5H2,1-3H3,(H,16,17,18).
What are the key properties of N,2-diethyl-6-(2-methylphenyl)pyrimidin-4-amine?
N,2-diethyl-6-(2-methylphenyl)pyrimidin-4-amine has a molecular weight of 241.34 g/mol, XLogP of 3.45, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-diethyl-6-(2-methylphenyl)pyrimidin-4-amine is sourced from PubChem (CID 80935861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).