[4-(2,3,5,6-tetramethylphenyl)pyrimidin-2-yl]methanamine

C15H19N3 — CID 82477561

IUPAC[4-(2,3,5,6-tetramethylphenyl)pyrimidin-2-yl]methanamine
SMILESCc1cc(C)c(C)c(-c2ccnc(CN)n2)c1C
InChIInChI=1S/C15H19N3/c1-9-7-10(2)12(4)15(11(9)3)13-5-6-17-14(8-16)18-13/h5-7H,8,16H2,1-4H3
InChIKeySVCBZKMGAYMCJS-UHFFFAOYSA-N
MW241.34 g/mol
LogP2.84
Rot. Bonds2

About [4-(2,3,5,6-tetramethylphenyl)pyrimidin-2-yl]methanamine

[4-(2,3,5,6-tetramethylphenyl)pyrimidin-2-yl]methanamine (PubChem CID 82477561) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is [4-(2,3,5,6-tetramethylphenyl)pyrimidin-2-yl]methanamine.

Molecular Properties

Compound Name[4-(2,3,5,6-tetramethylphenyl)pyrimidin-2-yl]methanamine
PubChem CID82477561
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC Name[4-(2,3,5,6-tetramethylphenyl)pyrimidin-2-yl]methanamine
SMILESCc1cc(C)c(C)c(-c2ccnc(CN)n2)c1C
InChIInChI=1S/C15H19N3/c1-9-7-10(2)12(4)15(11(9)3)13-5-6-17-14(8-16)18-13/h5-7H,8,16H2,1-4H3
InChIKeySVCBZKMGAYMCJS-UHFFFAOYSA-N
XLogP2.84
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 ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[4-(2,3,5,6-tetramethylphenyl)pyrimidin-2-yl]methyl]ethanamine
CID 116898515
2-[4-(2,3,5,6-tetramethylphenyl)pyrimidin-2-yl]acetic acid
CID 82488194
[4-(2,5-dimethylphenyl)pyrimidin-2-yl]methanamine
CID 82471015
[4-(7-methyl-2,3-dihydro-1,4-benzodioxin-6-yl)pyrimidin-2-yl]methanamine
CID 82482950
2-(azetidin-3-yl)-4-(2,3,5,6-tetramethylphenyl)pyrimidine
CID 116898708
[4-(3-fluoro-4-methoxyphenyl)pyrimidin-2-yl]methanamine
CID 82475463
[4-(4-propan-2-ylphenyl)pyrimidin-2-yl]methanamine
CID 82473712
2-(2-chloroethyl)-4-(2,4,6-trimethylphenyl)pyrimidine
CID 116899345
2-[4-(2,3,4-trimethylphenyl)pyrimidin-2-yl]ethanamine
CID 116897730
[4-(2-bromophenyl)pyrimidin-2-yl]methanamine
CID 84711190
4-[[3-[2-(aminomethyl)pyrimidin-4-yl]-2-pyridinyl]oxy]-3-methylaniline
CID 66970372
[3-(2,3,5,6-tetramethylphenyl)-1H-pyrazol-5-yl]methanamine
CID 82474207

Frequently Asked Questions

What is the IUPAC name of [4-(2,3,5,6-tetramethylphenyl)pyrimidin-2-yl]methanamine?
The IUPAC name of [4-(2,3,5,6-tetramethylphenyl)pyrimidin-2-yl]methanamine (CID 82477561) is [4-(2,3,5,6-tetramethylphenyl)pyrimidin-2-yl]methanamine.
What is the SMILES notation for [4-(2,3,5,6-tetramethylphenyl)pyrimidin-2-yl]methanamine?
The canonical SMILES for [4-(2,3,5,6-tetramethylphenyl)pyrimidin-2-yl]methanamine is Cc1cc(C)c(C)c(-c2ccnc(CN)n2)c1C.
What is the InChIKey of [4-(2,3,5,6-tetramethylphenyl)pyrimidin-2-yl]methanamine?
The InChIKey is SVCBZKMGAYMCJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-9-7-10(2)12(4)15(11(9)3)13-5-6-17-14(8-16)18-13/h5-7H,8,16H2,1-4H3.
What are the key properties of [4-(2,3,5,6-tetramethylphenyl)pyrimidin-2-yl]methanamine?
[4-(2,3,5,6-tetramethylphenyl)pyrimidin-2-yl]methanamine has a molecular weight of 241.34 g/mol, XLogP of 2.84, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2,3,5,6-tetramethylphenyl)pyrimidin-2-yl]methanamine is sourced from PubChem (CID 82477561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).