2-(2,6-dichlorophenyl)-5,6-dimethyl-N-propylpyrimidin-4-amine

C15H17Cl2N3 — CID 63480505

IUPAC2-(2,6-dichlorophenyl)-5,6-dimethyl-N-propylpyrimidin-4-amine
SMILESCCCNc1nc(-c2c(Cl)cccc2Cl)nc(C)c1C
InChIInChI=1S/C15H17Cl2N3/c1-4-8-18-14-9(2)10(3)19-15(20-14)13-11(16)6-5-7-12(13)17/h5-7H,4,8H2,1-3H3,(H,18,19,20)
InChIKeyCECHRNHPCLKLOB-UHFFFAOYSA-N
MW310.23 g/mol
LogP4.89
Rot. Bonds4

About 2-(2,6-dichlorophenyl)-5,6-dimethyl-N-propylpyrimidin-4-amine

2-(2,6-dichlorophenyl)-5,6-dimethyl-N-propylpyrimidin-4-amine (PubChem CID 63480505) has the molecular formula C15H17Cl2N3 and a molecular weight of 310.23 g/mol. Its IUPAC name is 2-(2,6-dichlorophenyl)-5,6-dimethyl-N-propylpyrimidin-4-amine.

Molecular Properties

Compound Name2-(2,6-dichlorophenyl)-5,6-dimethyl-N-propylpyrimidin-4-amine
PubChem CID63480505
Molecular FormulaC15H17Cl2N3
Molecular Weight310.23 g/mol
Exact Mass309.08
IUPAC Name2-(2,6-dichlorophenyl)-5,6-dimethyl-N-propylpyrimidin-4-amine
SMILESCCCNc1nc(-c2c(Cl)cccc2Cl)nc(C)c1C
InChIInChI=1S/C15H17Cl2N3/c1-4-8-18-14-9(2)10(3)19-15(20-14)13-11(16)6-5-7-12(13)17/h5-7H,4,8H2,1-3H3,(H,18,19,20)
InChIKeyCECHRNHPCLKLOB-UHFFFAOYSA-N
XLogP4.89
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.23
LogP ≤ 54.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-bromo-2-(2,6-dichlorophenyl)-6-methyl-N-propylpyrimidin-4-amine
CID 66295533
2-(3-chloro-2-fluorophenyl)-5,6-dimethyl-N-propylpyrimidin-4-amine
CID 114488677
2-(2-chloro-6-methoxyphenyl)-5-fluoro-6-methyl-N-propylpyrimidin-4-amine
CID 104818259
2-(2,6-dichlorophenyl)-5-ethyl-N,6-dimethylpyrimidin-4-amine
CID 55220126
5,6-dimethyl-N-propyl-2-(2-propylpyrazol-3-yl)pyrimidin-4-amine
CID 114557302
5,6-dimethyl-2-(3-nitrophenyl)-N-propylpyrimidin-4-amine
CID 62192565
2-(2,6-dichlorophenyl)-6-ethyl-N,5-dimethylpyrimidin-4-amine
CID 55222206
2-[(2,4-dichlorophenyl)methyl]-5,6-dimethyl-N-propylpyrimidin-4-amine
CID 63486136
5-bromo-2-(3-chlorophenyl)-6-methyl-N-propylpyrimidin-4-amine
CID 66304892
6-(2,3-dichlorophenyl)-2-ethyl-5-methyl-N-propylpyrimidin-4-amine
CID 80970830
2-(4-bromothiophen-2-yl)-5,6-dimethyl-N-propylpyrimidin-4-amine
CID 55194037
2-[(2,6-dichlorophenyl)methyl]-N-ethyl-5,6-dimethylpyrimidin-4-amine
CID 63485964

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dichlorophenyl)-5,6-dimethyl-N-propylpyrimidin-4-amine?
The IUPAC name of 2-(2,6-dichlorophenyl)-5,6-dimethyl-N-propylpyrimidin-4-amine (CID 63480505) is 2-(2,6-dichlorophenyl)-5,6-dimethyl-N-propylpyrimidin-4-amine.
What is the SMILES notation for 2-(2,6-dichlorophenyl)-5,6-dimethyl-N-propylpyrimidin-4-amine?
The canonical SMILES for 2-(2,6-dichlorophenyl)-5,6-dimethyl-N-propylpyrimidin-4-amine is CCCNc1nc(-c2c(Cl)cccc2Cl)nc(C)c1C.
What is the InChIKey of 2-(2,6-dichlorophenyl)-5,6-dimethyl-N-propylpyrimidin-4-amine?
The InChIKey is CECHRNHPCLKLOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17Cl2N3/c1-4-8-18-14-9(2)10(3)19-15(20-14)13-11(16)6-5-7-12(13)17/h5-7H,4,8H2,1-3H3,(H,18,19,20).
What are the key properties of 2-(2,6-dichlorophenyl)-5,6-dimethyl-N-propylpyrimidin-4-amine?
2-(2,6-dichlorophenyl)-5,6-dimethyl-N-propylpyrimidin-4-amine has a molecular weight of 310.23 g/mol, XLogP of 4.89, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dichlorophenyl)-5,6-dimethyl-N-propylpyrimidin-4-amine is sourced from PubChem (CID 63480505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).