4,6-dimethyl-N-(1-phenylpropan-2-yl)pyrimidin-2-amine

C15H19N3 — CID 63011106

IUPAC4,6-dimethyl-N-(1-phenylpropan-2-yl)pyrimidin-2-amine
SMILESCc1cc(C)nc(NC(C)Cc2ccccc2)n1
InChIInChI=1S/C15H19N3/c1-11-9-12(2)17-15(16-11)18-13(3)10-14-7-5-4-6-8-14/h4-9,13H,10H2,1-3H3,(H,16,17,18)
InChIKeyCEMDBHDYSJRFSR-UHFFFAOYSA-N
MW241.34 g/mol
LogP3.14
Rot. Bonds4

About 4,6-dimethyl-N-(1-phenylpropan-2-yl)pyrimidin-2-amine

4,6-dimethyl-N-(1-phenylpropan-2-yl)pyrimidin-2-amine (PubChem CID 63011106) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is 4,6-dimethyl-N-(1-phenylpropan-2-yl)pyrimidin-2-amine.

Molecular Properties

Compound Name4,6-dimethyl-N-(1-phenylpropan-2-yl)pyrimidin-2-amine
PubChem CID63011106
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC Name4,6-dimethyl-N-(1-phenylpropan-2-yl)pyrimidin-2-amine
SMILESCc1cc(C)nc(NC(C)Cc2ccccc2)n1
InChIInChI=1S/C15H19N3/c1-11-9-12(2)17-15(16-11)18-13(3)10-14-7-5-4-6-8-14/h4-9,13H,10H2,1-3H3,(H,16,17,18)
InChIKeyCEMDBHDYSJRFSR-UHFFFAOYSA-N
XLogP3.14
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-methyl-2-(1-phenylpropan-2-ylamino)pyrimidine-4-carboxylic acid
CID 107553898
4-methyl-N-(1-phenylpropan-2-yl)-6-propan-2-yloxypyrimidin-2-amine
CID 115975028
2,6-dimethyl-N-(1-phenylpropan-2-yl)pyridin-4-amine
CID 114272175
4,6-dimethoxy-N-(1-phenylpropan-2-yl)pyrimidin-2-amine
CID 115355116
4,6-dimethyl-N-(4-methylpentan-2-yl)pyrimidin-2-amine
CID 43518888
2-N,4-N-bis(1-phenylpropan-2-yl)quinazoline-2,4-diamine
CID 19939147
2-[1-(4-fluorophenyl)propan-2-ylamino]-6-methylpyrimidine-4-carboxylic acid
CID 107553885
4-N-benzyl-2-N-butan-2-yl-6-methylpyrimidine-2,4-diamine
CID 112909056
N-benzyl-2-[(4,6-dimethylpyrimidin-2-yl)amino]-3-phenylpropanamide
CID 91638983
2-N-(4,6-dimethylpyrimidin-2-yl)propane-1,2-diamine
CID 63732356
2-[(4,6-dimethylpyrimidin-2-yl)amino]-N-(2-hydroxyethyl)-3-phenylpropanamide
CID 91639743
4-methyl-2-(1-phenylpropan-2-ylamino)pyrimidine-5-carboxylic acid
CID 83181314

Frequently Asked Questions

What is the IUPAC name of 4,6-dimethyl-N-(1-phenylpropan-2-yl)pyrimidin-2-amine?
The IUPAC name of 4,6-dimethyl-N-(1-phenylpropan-2-yl)pyrimidin-2-amine (CID 63011106) is 4,6-dimethyl-N-(1-phenylpropan-2-yl)pyrimidin-2-amine.
What is the SMILES notation for 4,6-dimethyl-N-(1-phenylpropan-2-yl)pyrimidin-2-amine?
The canonical SMILES for 4,6-dimethyl-N-(1-phenylpropan-2-yl)pyrimidin-2-amine is Cc1cc(C)nc(NC(C)Cc2ccccc2)n1.
What is the InChIKey of 4,6-dimethyl-N-(1-phenylpropan-2-yl)pyrimidin-2-amine?
The InChIKey is CEMDBHDYSJRFSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-11-9-12(2)17-15(16-11)18-13(3)10-14-7-5-4-6-8-14/h4-9,13H,10H2,1-3H3,(H,16,17,18).
What are the key properties of 4,6-dimethyl-N-(1-phenylpropan-2-yl)pyrimidin-2-amine?
4,6-dimethyl-N-(1-phenylpropan-2-yl)pyrimidin-2-amine has a molecular weight of 241.34 g/mol, XLogP of 3.14, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dimethyl-N-(1-phenylpropan-2-yl)pyrimidin-2-amine is sourced from PubChem (CID 63011106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).