6-methyl-2-naphthalen-1-yl-5-propan-2-ylpyrimidin-4-amine

C18H19N3 — CID 62916015

IUPAC6-methyl-2-naphthalen-1-yl-5-propan-2-ylpyrimidin-4-amine
SMILESCc1nc(-c2cccc3ccccc23)nc(N)c1C(C)C
InChIInChI=1S/C18H19N3/c1-11(2)16-12(3)20-18(21-17(16)19)15-10-6-8-13-7-4-5-9-14(13)15/h4-11H,1-3H3,(H2,19,20,21)
InChIKeyHLZBRDWYIVKVIU-UHFFFAOYSA-N
MW277.37 g/mol
LogP4.31
Rot. Bonds2

About 6-methyl-2-naphthalen-1-yl-5-propan-2-ylpyrimidin-4-amine

6-methyl-2-naphthalen-1-yl-5-propan-2-ylpyrimidin-4-amine (PubChem CID 62916015) has the molecular formula C18H19N3 and a molecular weight of 277.37 g/mol. Its IUPAC name is 6-methyl-2-naphthalen-1-yl-5-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound Name6-methyl-2-naphthalen-1-yl-5-propan-2-ylpyrimidin-4-amine
PubChem CID62916015
Molecular FormulaC18H19N3
Molecular Weight277.37 g/mol
Exact Mass277.16
IUPAC Name6-methyl-2-naphthalen-1-yl-5-propan-2-ylpyrimidin-4-amine
SMILESCc1nc(-c2cccc3ccccc23)nc(N)c1C(C)C
InChIInChI=1S/C18H19N3/c1-11(2)16-12(3)20-18(21-17(16)19)15-10-6-8-13-7-4-5-9-14(13)15/h4-11H,1-3H3,(H2,19,20,21)
InChIKeyHLZBRDWYIVKVIU-UHFFFAOYSA-N
XLogP4.31
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-methyl-5-propan-2-yl-2-quinolin-4-ylpyrimidin-4-amine
CID 63868655
2-(2,4-dimethylphenyl)-6-methyl-5-propan-2-ylpyrimidin-4-amine
CID 62913279
2-naphthalen-1-yl-6-propan-2-ylpyrimidin-4-amine
CID 62203179
6-methyl-2-(4-methylphenyl)-5-propan-2-ylpyrimidin-4-amine
CID 62914005
1-(4,6-dimethyl-2-naphthalen-1-ylpyrimidin-5-yl)-N-methylmethanamine
CID 62744265
2-(1,5-dimethylpyrazol-4-yl)-6-methyl-5-propan-2-ylpyrimidin-4-amine
CID 79584035
2-naphthalen-1-yl-5-propan-2-ylpyrimidine
CID 176640404
4-chloro-5-iodo-6-methyl-2-naphthalen-1-ylpyrimidine
CID 66293961
2-[2-fluoro-4-(2-methylbutan-2-yl)phenyl]-6-methyl-5-propan-2-ylpyrimidin-4-amine
CID 155354355
5-bromo-6-methyl-2-(2-methylphenyl)pyrimidin-4-amine
CID 66306257
N-ethyl-5,6-dimethyl-2-naphthalen-1-ylpyrimidin-4-amine
CID 63486132
5-bromo-2-isoquinolin-4-yl-6-methylpyrimidin-4-amine
CID 104504891

Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-naphthalen-1-yl-5-propan-2-ylpyrimidin-4-amine?
The IUPAC name of 6-methyl-2-naphthalen-1-yl-5-propan-2-ylpyrimidin-4-amine (CID 62916015) is 6-methyl-2-naphthalen-1-yl-5-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for 6-methyl-2-naphthalen-1-yl-5-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for 6-methyl-2-naphthalen-1-yl-5-propan-2-ylpyrimidin-4-amine is Cc1nc(-c2cccc3ccccc23)nc(N)c1C(C)C.
What is the InChIKey of 6-methyl-2-naphthalen-1-yl-5-propan-2-ylpyrimidin-4-amine?
The InChIKey is HLZBRDWYIVKVIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3/c1-11(2)16-12(3)20-18(21-17(16)19)15-10-6-8-13-7-4-5-9-14(13)15/h4-11H,1-3H3,(H2,19,20,21).
What are the key properties of 6-methyl-2-naphthalen-1-yl-5-propan-2-ylpyrimidin-4-amine?
6-methyl-2-naphthalen-1-yl-5-propan-2-ylpyrimidin-4-amine has a molecular weight of 277.37 g/mol, XLogP of 4.31, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-naphthalen-1-yl-5-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 62916015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).