1-methyl-N-[(3-methylphenyl)-phenylmethyl]-5,6-dihydro-4H-pyrimidin-2-amine

C19H23N3 — CID 23328932

IUPAC1-methyl-N-[(3-methylphenyl)-phenylmethyl]-5,6-dihydro-4H-pyrimidin-2-amine
SMILESCc1cccc(C(NC2=NCCCN2C)c2ccccc2)c1
InChIInChI=1S/C19H23N3/c1-15-8-6-11-17(14-15)18(16-9-4-3-5-10-16)21-19-20-12-7-13-22(19)2/h3-6,8-11,14,18H,7,12-13H2,1-2H3,(H,20,21)
InChIKeyHRYKALRFFVQLGK-UHFFFAOYSA-N
MW293.41 g/mol
LogP3.37
Rot. Bonds3

About 1-methyl-N-[(3-methylphenyl)-phenylmethyl]-5,6-dihydro-4H-pyrimidin-2-amine

1-methyl-N-[(3-methylphenyl)-phenylmethyl]-5,6-dihydro-4H-pyrimidin-2-amine (PubChem CID 23328932) has the molecular formula C19H23N3 and a molecular weight of 293.41 g/mol. Its IUPAC name is 1-methyl-N-[(3-methylphenyl)-phenylmethyl]-5,6-dihydro-4H-pyrimidin-2-amine.

Molecular Properties

Compound Name1-methyl-N-[(3-methylphenyl)-phenylmethyl]-5,6-dihydro-4H-pyrimidin-2-amine
PubChem CID23328932
Molecular FormulaC19H23N3
Molecular Weight293.41 g/mol
Exact Mass293.19
IUPAC Name1-methyl-N-[(3-methylphenyl)-phenylmethyl]-5,6-dihydro-4H-pyrimidin-2-amine
SMILESCc1cccc(C(NC2=NCCCN2C)c2ccccc2)c1
InChIInChI=1S/C19H23N3/c1-15-8-6-11-17(14-15)18(16-9-4-3-5-10-16)21-19-20-12-7-13-22(19)2/h3-6,8-11,14,18H,7,12-13H2,1-2H3,(H,20,21)
InChIKeyHRYKALRFFVQLGK-UHFFFAOYSA-N
XLogP3.37
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.41
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-[(3-methylphenyl)-phenylmethyl]-5,6-dihydro-4H-pyrimidin-2-amine?
The IUPAC name of 1-methyl-N-[(3-methylphenyl)-phenylmethyl]-5,6-dihydro-4H-pyrimidin-2-amine (CID 23328932) is 1-methyl-N-[(3-methylphenyl)-phenylmethyl]-5,6-dihydro-4H-pyrimidin-2-amine.
What is the SMILES notation for 1-methyl-N-[(3-methylphenyl)-phenylmethyl]-5,6-dihydro-4H-pyrimidin-2-amine?
The canonical SMILES for 1-methyl-N-[(3-methylphenyl)-phenylmethyl]-5,6-dihydro-4H-pyrimidin-2-amine is Cc1cccc(C(NC2=NCCCN2C)c2ccccc2)c1.
What is the InChIKey of 1-methyl-N-[(3-methylphenyl)-phenylmethyl]-5,6-dihydro-4H-pyrimidin-2-amine?
The InChIKey is HRYKALRFFVQLGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3/c1-15-8-6-11-17(14-15)18(16-9-4-3-5-10-16)21-19-20-12-7-13-22(19)2/h3-6,8-11,14,18H,7,12-13H2,1-2H3,(H,20,21).
What are the key properties of 1-methyl-N-[(3-methylphenyl)-phenylmethyl]-5,6-dihydro-4H-pyrimidin-2-amine?
1-methyl-N-[(3-methylphenyl)-phenylmethyl]-5,6-dihydro-4H-pyrimidin-2-amine has a molecular weight of 293.41 g/mol, XLogP of 3.37, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[(3-methylphenyl)-phenylmethyl]-5,6-dihydro-4H-pyrimidin-2-amine is sourced from PubChem (CID 23328932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).