N-methyl-5-propyl-6-(2,4,6-trimethylphenyl)pyrimidin-4-amine

C17H23N3 — CID 115503443

IUPACN-methyl-5-propyl-6-(2,4,6-trimethylphenyl)pyrimidin-4-amine
SMILESCCCc1c(NC)ncnc1-c1c(C)cc(C)cc1C
InChIInChI=1S/C17H23N3/c1-6-7-14-16(19-10-20-17(14)18-5)15-12(3)8-11(2)9-13(15)4/h8-10H,6-7H2,1-5H3,(H,18,19,20)
InChIKeyMGANSQATNKQVTJ-UHFFFAOYSA-N
MW269.39 g/mol
LogP4.06
Rot. Bonds4

About N-methyl-5-propyl-6-(2,4,6-trimethylphenyl)pyrimidin-4-amine

N-methyl-5-propyl-6-(2,4,6-trimethylphenyl)pyrimidin-4-amine (PubChem CID 115503443) has the molecular formula C17H23N3 and a molecular weight of 269.39 g/mol. Its IUPAC name is N-methyl-5-propyl-6-(2,4,6-trimethylphenyl)pyrimidin-4-amine.

Molecular Properties

Compound NameN-methyl-5-propyl-6-(2,4,6-trimethylphenyl)pyrimidin-4-amine
PubChem CID115503443
Molecular FormulaC17H23N3
Molecular Weight269.39 g/mol
Exact Mass269.19
IUPAC NameN-methyl-5-propyl-6-(2,4,6-trimethylphenyl)pyrimidin-4-amine
SMILESCCCc1c(NC)ncnc1-c1c(C)cc(C)cc1C
InChIInChI=1S/C17H23N3/c1-6-7-14-16(19-10-20-17(14)18-5)15-12(3)8-11(2)9-13(15)4/h8-10H,6-7H2,1-5H3,(H,18,19,20)
InChIKeyMGANSQATNKQVTJ-UHFFFAOYSA-N
XLogP4.06
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,5-dimethyl-6-(2,4,6-trimethylphenyl)pyrimidin-4-amine
CID 113324602
5-ethyl-6-(2-methoxy-4,6-dimethylphenyl)-N-methylpyrimidin-4-amine
CID 106681496
4-N-ethyl-6-N-methyl-5-propylpyrimidine-4,6-diamine
CID 80770650
4-N-(3,5-dimethylphenyl)-4-N,6-N-dimethyl-5-propylpyrimidine-4,6-diamine
CID 80795100
6-(3-fluoro-5-methylphenyl)-N,5-dipropylpyrimidin-4-amine
CID 79691423
4-N-(3,5-difluorophenyl)-6-N-methyl-5-propylpyrimidine-4,6-diamine
CID 80762442
6-(2-bromo-4-methylphenoxy)-N-methyl-5-propylpyrimidin-4-amine
CID 80860005
4-N-(2,6-difluoro-3-methylphenyl)-6-N-methyl-5-propylpyrimidine-4,6-diamine
CID 82803367
6-(3-methylthiophen-2-yl)-N,5-dipropylpyrimidin-4-amine
CID 79992418
6-N-methyl-4-N-(4-methylpentyl)-5-propylpyrimidine-4,6-diamine
CID 80831818
6-N-methyl-4-N-(3-methyl-2-propan-2-ylbutyl)-5-propylpyrimidine-4,6-diamine
CID 102908880
N-methyl-5-propyl-6-[4-(trifluoromethyl)-3-pyridinyl]pyrimidin-4-amine
CID 102709064

Frequently Asked Questions

What is the IUPAC name of N-methyl-5-propyl-6-(2,4,6-trimethylphenyl)pyrimidin-4-amine?
The IUPAC name of N-methyl-5-propyl-6-(2,4,6-trimethylphenyl)pyrimidin-4-amine (CID 115503443) is N-methyl-5-propyl-6-(2,4,6-trimethylphenyl)pyrimidin-4-amine.
What is the SMILES notation for N-methyl-5-propyl-6-(2,4,6-trimethylphenyl)pyrimidin-4-amine?
The canonical SMILES for N-methyl-5-propyl-6-(2,4,6-trimethylphenyl)pyrimidin-4-amine is CCCc1c(NC)ncnc1-c1c(C)cc(C)cc1C.
What is the InChIKey of N-methyl-5-propyl-6-(2,4,6-trimethylphenyl)pyrimidin-4-amine?
The InChIKey is MGANSQATNKQVTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3/c1-6-7-14-16(19-10-20-17(14)18-5)15-12(3)8-11(2)9-13(15)4/h8-10H,6-7H2,1-5H3,(H,18,19,20).
What are the key properties of N-methyl-5-propyl-6-(2,4,6-trimethylphenyl)pyrimidin-4-amine?
N-methyl-5-propyl-6-(2,4,6-trimethylphenyl)pyrimidin-4-amine has a molecular weight of 269.39 g/mol, XLogP of 4.06, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-propyl-6-(2,4,6-trimethylphenyl)pyrimidin-4-amine is sourced from PubChem (CID 115503443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).