1-ethyl-N-(furan-2-ylmethyl)-8-phenylimidazo[1,5-c]pyrimidin-5-amine

C19H18N4O — CID 164820444

IUPAC1-ethyl-N-(furan-2-ylmethyl)-8-phenylimidazo[1,5-c]pyrimidin-5-amine
SMILESCCc1ncn2c(NCc3ccco3)ncc(-c3ccccc3)c12
InChIInChI=1S/C19H18N4O/c1-2-17-18-16(14-7-4-3-5-8-14)12-21-19(23(18)13-22-17)20-11-15-9-6-10-24-15/h3-10,12-13H,2,11H2,1H3,(H,20,21)
InChIKeyTVGCXYLGOBVSBB-UHFFFAOYSA-N
MW318.38 g/mol
LogP4.16
Rot. Bonds5

About 1-ethyl-N-(furan-2-ylmethyl)-8-phenylimidazo[1,5-c]pyrimidin-5-amine

1-ethyl-N-(furan-2-ylmethyl)-8-phenylimidazo[1,5-c]pyrimidin-5-amine (PubChem CID 164820444) has the molecular formula C19H18N4O and a molecular weight of 318.38 g/mol. Its IUPAC name is 1-ethyl-N-(furan-2-ylmethyl)-8-phenylimidazo[1,5-c]pyrimidin-5-amine.

Molecular Properties

Compound Name1-ethyl-N-(furan-2-ylmethyl)-8-phenylimidazo[1,5-c]pyrimidin-5-amine
PubChem CID164820444
Molecular FormulaC19H18N4O
Molecular Weight318.38 g/mol
Exact Mass318.15
IUPAC Name1-ethyl-N-(furan-2-ylmethyl)-8-phenylimidazo[1,5-c]pyrimidin-5-amine
SMILESCCc1ncn2c(NCc3ccco3)ncc(-c3ccccc3)c12
InChIInChI=1S/C19H18N4O/c1-2-17-18-16(14-7-4-3-5-8-14)12-21-19(23(18)13-22-17)20-11-15-9-6-10-24-15/h3-10,12-13H,2,11H2,1H3,(H,20,21)
InChIKeyTVGCXYLGOBVSBB-UHFFFAOYSA-N
XLogP4.16
TPSA55.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.38
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(furan-2-ylmethyl)-1-methyl-8-phenylimidazo[1,5-c]pyrimidin-5-amine
CID 164820330
[5-(furan-2-ylmethylamino)-3-phenyl-1,2,4-triazol-1-yl]-phenylmethanone
CID 3974873
2-ethyl-N-(furan-2-ylmethyl)-5-phenylthieno[2,3-d]pyrimidin-4-amine
CID 68622626
N-(furan-2-ylmethyl)-2-phenyl-[1,2,4]triazolo[1,5-c]quinazolin-5-amine
CID 16584672
N-(furan-2-ylmethyl)-8-(4-methylcyclohexen-1-yl)-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine
CID 166785639
N-(furan-2-ylmethyl)-3-phenyl-[1,2,4]triazolo[4,3-b][1,2,4,5]tetrazin-6-amine
CID 557420
N-(furan-2-ylmethyl)-8-(1H-indol-7-yl)-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine
CID 167312313
[5-(furan-2-ylmethylamino)-3-(4-methylphenyl)-1,2,4-triazol-1-yl]-phenylmethanone
CID 2972077
2,2-difluoro-1-[4-[5-(furan-2-ylmethylamino)-[1,2,4]triazolo[4,3-c]pyrimidin-8-yl]-3,6-dihydro-2H-pyridin-1-yl]propan-1-one
CID 138516178
N-(furan-2-ylmethyl)-2-phenyl-6-piperidin-1-ylpyrimidin-4-amine
CID 112880103
6-N-butyl-4-N-(furan-2-ylmethyl)-2-phenylpyrimidine-4,6-diamine
CID 112879724
5,6-diethyl-3-(furan-2-ylmethylamino)pyridazine-4-carboxylic acid
CID 80516258

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-(furan-2-ylmethyl)-8-phenylimidazo[1,5-c]pyrimidin-5-amine?
The IUPAC name of 1-ethyl-N-(furan-2-ylmethyl)-8-phenylimidazo[1,5-c]pyrimidin-5-amine (CID 164820444) is 1-ethyl-N-(furan-2-ylmethyl)-8-phenylimidazo[1,5-c]pyrimidin-5-amine.
What is the SMILES notation for 1-ethyl-N-(furan-2-ylmethyl)-8-phenylimidazo[1,5-c]pyrimidin-5-amine?
The canonical SMILES for 1-ethyl-N-(furan-2-ylmethyl)-8-phenylimidazo[1,5-c]pyrimidin-5-amine is CCc1ncn2c(NCc3ccco3)ncc(-c3ccccc3)c12.
What is the InChIKey of 1-ethyl-N-(furan-2-ylmethyl)-8-phenylimidazo[1,5-c]pyrimidin-5-amine?
The InChIKey is TVGCXYLGOBVSBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O/c1-2-17-18-16(14-7-4-3-5-8-14)12-21-19(23(18)13-22-17)20-11-15-9-6-10-24-15/h3-10,12-13H,2,11H2,1H3,(H,20,21).
What are the key properties of 1-ethyl-N-(furan-2-ylmethyl)-8-phenylimidazo[1,5-c]pyrimidin-5-amine?
1-ethyl-N-(furan-2-ylmethyl)-8-phenylimidazo[1,5-c]pyrimidin-5-amine has a molecular weight of 318.38 g/mol, XLogP of 4.16, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-(furan-2-ylmethyl)-8-phenylimidazo[1,5-c]pyrimidin-5-amine is sourced from PubChem (CID 164820444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).