4-(2,4-dimethylphenyl)-6-propan-2-ylpyrimidin-2-amine

C15H19N3 — CID 82293115

IUPAC4-(2,4-dimethylphenyl)-6-propan-2-ylpyrimidin-2-amine
SMILESCc1ccc(-c2cc(C(C)C)nc(N)n2)c(C)c1
InChIInChI=1S/C15H19N3/c1-9(2)13-8-14(18-15(16)17-13)12-6-5-10(3)7-11(12)4/h5-9H,1-4H3,(H2,16,17,18)
InChIKeyMBWLFAACWHQBGW-UHFFFAOYSA-N
MW241.34 g/mol
LogP3.47
Rot. Bonds2

About 4-(2,4-dimethylphenyl)-6-propan-2-ylpyrimidin-2-amine

4-(2,4-dimethylphenyl)-6-propan-2-ylpyrimidin-2-amine (PubChem CID 82293115) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is 4-(2,4-dimethylphenyl)-6-propan-2-ylpyrimidin-2-amine.

Molecular Properties

Compound Name4-(2,4-dimethylphenyl)-6-propan-2-ylpyrimidin-2-amine
PubChem CID82293115
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC Name4-(2,4-dimethylphenyl)-6-propan-2-ylpyrimidin-2-amine
SMILESCc1ccc(-c2cc(C(C)C)nc(N)n2)c(C)c1
InChIInChI=1S/C15H19N3/c1-9(2)13-8-14(18-15(16)17-13)12-6-5-10(3)7-11(12)4/h5-9H,1-4H3,(H2,16,17,18)
InChIKeyMBWLFAACWHQBGW-UHFFFAOYSA-N
XLogP3.47
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(4-methylnaphthalen-1-yl)-6-propan-2-ylpyrimidin-2-amine
CID 15435581
4-chloro-6-(2,4-dimethylphenyl)pyrimidin-2-amine
CID 141218795
2-(2,4-dimethylphenyl)-6-propan-2-ylpyrimidin-4-amine
CID 55045645
4-(4-methoxy-2,3-dimethylphenyl)-6-propan-2-ylpyrimidin-2-amine
CID 95474541
4-(4,8-difluoronaphthalen-1-yl)-6-propan-2-ylpyrimidin-2-amine
CID 15864232
1-[4-(2,4-dimethylphenyl)-6-methylpyrimidin-2-yl]ethanamine
CID 116892482
4-(4-fluorophenyl)-6-propan-2-ylpyrimidin-2-amine
CID 14545360
6-(2,4-dimethylphenyl)-2,3-dimethylpyridine;ethane
CID 176948420
4-(3-chlorophenyl)-6-propan-2-ylpyrimidin-2-amine
CID 82296144
6-propan-2-ylpyrimidine-2,4-diamine
CID 12655163
2,4-bis(2,4-dimethylphenyl)-6-propan-2-yl-1,3,5-triazine
CID 126550804
2-(2,4-dimethylphenyl)-6-methyl-5-propan-2-ylpyrimidin-4-amine
CID 62913279

Frequently Asked Questions

What is the IUPAC name of 4-(2,4-dimethylphenyl)-6-propan-2-ylpyrimidin-2-amine?
The IUPAC name of 4-(2,4-dimethylphenyl)-6-propan-2-ylpyrimidin-2-amine (CID 82293115) is 4-(2,4-dimethylphenyl)-6-propan-2-ylpyrimidin-2-amine.
What is the SMILES notation for 4-(2,4-dimethylphenyl)-6-propan-2-ylpyrimidin-2-amine?
The canonical SMILES for 4-(2,4-dimethylphenyl)-6-propan-2-ylpyrimidin-2-amine is Cc1ccc(-c2cc(C(C)C)nc(N)n2)c(C)c1.
What is the InChIKey of 4-(2,4-dimethylphenyl)-6-propan-2-ylpyrimidin-2-amine?
The InChIKey is MBWLFAACWHQBGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-9(2)13-8-14(18-15(16)17-13)12-6-5-10(3)7-11(12)4/h5-9H,1-4H3,(H2,16,17,18).
What are the key properties of 4-(2,4-dimethylphenyl)-6-propan-2-ylpyrimidin-2-amine?
4-(2,4-dimethylphenyl)-6-propan-2-ylpyrimidin-2-amine has a molecular weight of 241.34 g/mol, XLogP of 3.47, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,4-dimethylphenyl)-6-propan-2-ylpyrimidin-2-amine is sourced from PubChem (CID 82293115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).