2-(furan-2-yl)-6-phenyl-N-propylpyrimidin-4-amine

C17H17N3O — CID 63485214

IUPAC2-(furan-2-yl)-6-phenyl-N-propylpyrimidin-4-amine
SMILESCCCNc1cc(-c2ccccc2)nc(-c2ccco2)n1
InChIInChI=1S/C17H17N3O/c1-2-10-18-16-12-14(13-7-4-3-5-8-13)19-17(20-16)15-9-6-11-21-15/h3-9,11-12H,2,10H2,1H3,(H,18,19,20)
InChIKeyLVOHETGRSMZCHZ-UHFFFAOYSA-N
MW279.34 g/mol
LogP4.23
Rot. Bonds5

About 2-(furan-2-yl)-6-phenyl-N-propylpyrimidin-4-amine

2-(furan-2-yl)-6-phenyl-N-propylpyrimidin-4-amine (PubChem CID 63485214) has the molecular formula C17H17N3O and a molecular weight of 279.34 g/mol. Its IUPAC name is 2-(furan-2-yl)-6-phenyl-N-propylpyrimidin-4-amine.

Molecular Properties

Compound Name2-(furan-2-yl)-6-phenyl-N-propylpyrimidin-4-amine
PubChem CID63485214
Molecular FormulaC17H17N3O
Molecular Weight279.34 g/mol
Exact Mass279.14
IUPAC Name2-(furan-2-yl)-6-phenyl-N-propylpyrimidin-4-amine
SMILESCCCNc1cc(-c2ccccc2)nc(-c2ccco2)n1
InChIInChI=1S/C17H17N3O/c1-2-10-18-16-12-14(13-7-4-3-5-8-13)19-17(20-16)15-9-6-11-21-15/h3-9,11-12H,2,10H2,1H3,(H,18,19,20)
InChIKeyLVOHETGRSMZCHZ-UHFFFAOYSA-N
XLogP4.23
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-N-(furan-2-ylmethyl)-6-phenyl-2-N-propylpyrimidine-2,4-diamine
CID 112932522
2-tert-butyl-6-(furan-2-yl)-N-propylpyrimidin-4-amine
CID 80952417
6-phenyl-N,2-dipropylpyrimidin-4-amine
CID 55193281
N-ethyl-2-(furan-2-yl)-6-methylpyrimidin-4-amine
CID 62201507
4-N-benzyl-2-phenyl-6-N-propylpyrimidine-4,6-diamine
CID 112879191
6-phenyl-N-propyl-2-(trifluoromethyl)pyrimidin-4-amine
CID 106769168
4-N-pentyl-2-phenyl-6-N-propylpyrimidine-4,6-diamine
CID 112879234
6-ethyl-2-phenyl-N-propylpyrimidin-4-amine
CID 62192699
6-N-butyl-4-N-(furan-2-ylmethyl)-2-phenylpyrimidine-4,6-diamine
CID 112879724
6-phenyl-2-(4-phenylpiperazin-1-yl)-N-propylpyrimidin-4-amine
CID 112932417
2-N-(3-methylbutyl)-6-phenyl-4-N-propylpyrimidine-2,4-diamine
CID 112932435
6-phenyl-N-propyl-2-(4-pyrimidin-2-ylpiperazin-1-yl)pyrimidin-4-amine
CID 112932430

Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-6-phenyl-N-propylpyrimidin-4-amine?
The IUPAC name of 2-(furan-2-yl)-6-phenyl-N-propylpyrimidin-4-amine (CID 63485214) is 2-(furan-2-yl)-6-phenyl-N-propylpyrimidin-4-amine.
What is the SMILES notation for 2-(furan-2-yl)-6-phenyl-N-propylpyrimidin-4-amine?
The canonical SMILES for 2-(furan-2-yl)-6-phenyl-N-propylpyrimidin-4-amine is CCCNc1cc(-c2ccccc2)nc(-c2ccco2)n1.
What is the InChIKey of 2-(furan-2-yl)-6-phenyl-N-propylpyrimidin-4-amine?
The InChIKey is LVOHETGRSMZCHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O/c1-2-10-18-16-12-14(13-7-4-3-5-8-13)19-17(20-16)15-9-6-11-21-15/h3-9,11-12H,2,10H2,1H3,(H,18,19,20).
What are the key properties of 2-(furan-2-yl)-6-phenyl-N-propylpyrimidin-4-amine?
2-(furan-2-yl)-6-phenyl-N-propylpyrimidin-4-amine has a molecular weight of 279.34 g/mol, XLogP of 4.23, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-6-phenyl-N-propylpyrimidin-4-amine is sourced from PubChem (CID 63485214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).