N-(2,2-diphenylethyl)-1-methyl-5,6-dihydro-4H-pyrimidin-2-amine

C19H23N3 — CID 19820462

IUPACN-(2,2-diphenylethyl)-1-methyl-5,6-dihydro-4H-pyrimidin-2-amine
SMILESCN1CCCN=C1NCC(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H23N3/c1-22-14-8-13-20-19(22)21-15-18(16-9-4-2-5-10-16)17-11-6-3-7-12-17/h2-7,9-12,18H,8,13-15H2,1H3,(H,20,21)
InChIKeyYRIOSKSFIJUCOR-UHFFFAOYSA-N
MW293.41 g/mol
LogP3.10
Rot. Bonds4

About N-(2,2-diphenylethyl)-1-methyl-5,6-dihydro-4H-pyrimidin-2-amine

N-(2,2-diphenylethyl)-1-methyl-5,6-dihydro-4H-pyrimidin-2-amine (PubChem CID 19820462) has the molecular formula C19H23N3 and a molecular weight of 293.41 g/mol. Its IUPAC name is N-(2,2-diphenylethyl)-1-methyl-5,6-dihydro-4H-pyrimidin-2-amine.

Molecular Properties

Compound NameN-(2,2-diphenylethyl)-1-methyl-5,6-dihydro-4H-pyrimidin-2-amine
PubChem CID19820462
Molecular FormulaC19H23N3
Molecular Weight293.41 g/mol
Exact Mass293.19
IUPAC NameN-(2,2-diphenylethyl)-1-methyl-5,6-dihydro-4H-pyrimidin-2-amine
SMILESCN1CCCN=C1NCC(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H23N3/c1-22-14-8-13-20-19(22)21-15-18(16-9-4-2-5-10-16)17-11-6-3-7-12-17/h2-7,9-12,18H,8,13-15H2,1H3,(H,20,21)
InChIKeyYRIOSKSFIJUCOR-UHFFFAOYSA-N
XLogP3.10
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.41
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2,2-diphenylethyl)-1-methyl-5,6-dihydro-4H-pyrimidin-2-amine?
The IUPAC name of N-(2,2-diphenylethyl)-1-methyl-5,6-dihydro-4H-pyrimidin-2-amine (CID 19820462) is N-(2,2-diphenylethyl)-1-methyl-5,6-dihydro-4H-pyrimidin-2-amine.
What is the SMILES notation for N-(2,2-diphenylethyl)-1-methyl-5,6-dihydro-4H-pyrimidin-2-amine?
The canonical SMILES for N-(2,2-diphenylethyl)-1-methyl-5,6-dihydro-4H-pyrimidin-2-amine is CN1CCCN=C1NCC(c1ccccc1)c1ccccc1.
What is the InChIKey of N-(2,2-diphenylethyl)-1-methyl-5,6-dihydro-4H-pyrimidin-2-amine?
The InChIKey is YRIOSKSFIJUCOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3/c1-22-14-8-13-20-19(22)21-15-18(16-9-4-2-5-10-16)17-11-6-3-7-12-17/h2-7,9-12,18H,8,13-15H2,1H3,(H,20,21).
What are the key properties of N-(2,2-diphenylethyl)-1-methyl-5,6-dihydro-4H-pyrimidin-2-amine?
N-(2,2-diphenylethyl)-1-methyl-5,6-dihydro-4H-pyrimidin-2-amine has a molecular weight of 293.41 g/mol, XLogP of 3.10, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-diphenylethyl)-1-methyl-5,6-dihydro-4H-pyrimidin-2-amine is sourced from PubChem (CID 19820462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).