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

C18H16N4O — CID 164820330

IUPACN-(furan-2-ylmethyl)-1-methyl-8-phenylimidazo[1,5-c]pyrimidin-5-amine
SMILESCc1ncn2c(NCc3ccco3)ncc(-c3ccccc3)c12
InChIInChI=1S/C18H16N4O/c1-13-17-16(14-6-3-2-4-7-14)11-20-18(22(17)12-21-13)19-10-15-8-5-9-23-15/h2-9,11-12H,10H2,1H3,(H,19,20)
InChIKeyPXDBPXOVYXBLAB-UHFFFAOYSA-N
MW304.35 g/mol
LogP3.91
Rot. Bonds4

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

N-(furan-2-ylmethyl)-1-methyl-8-phenylimidazo[1,5-c]pyrimidin-5-amine (PubChem CID 164820330) has the molecular formula C18H16N4O and a molecular weight of 304.35 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-1-methyl-8-phenylimidazo[1,5-c]pyrimidin-5-amine.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-1-methyl-8-phenylimidazo[1,5-c]pyrimidin-5-amine
PubChem CID164820330
Molecular FormulaC18H16N4O
Molecular Weight304.35 g/mol
Exact Mass304.13
IUPAC NameN-(furan-2-ylmethyl)-1-methyl-8-phenylimidazo[1,5-c]pyrimidin-5-amine
SMILESCc1ncn2c(NCc3ccco3)ncc(-c3ccccc3)c12
InChIInChI=1S/C18H16N4O/c1-13-17-16(14-6-3-2-4-7-14)11-20-18(22(17)12-21-13)19-10-15-8-5-9-23-15/h2-9,11-12H,10H2,1H3,(H,19,20)
InChIKeyPXDBPXOVYXBLAB-UHFFFAOYSA-N
XLogP3.91
TPSA55.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.35
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-ethyl-N-(furan-2-ylmethyl)-8-phenylimidazo[1,5-c]pyrimidin-5-amine
CID 164820444
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-(4-methylcyclohexen-1-yl)-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine
CID 166785639
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-phenyl-1,2,4-triazol-1-yl]-phenylmethanone
CID 3974873
[5-(furan-2-ylmethylamino)-3-(4-methylphenyl)-1,2,4-triazol-1-yl]-phenylmethanone
CID 2972077
N-(furan-2-ylmethyl)-2-phenyl-[1,2,4]triazolo[1,5-c]quinazolin-5-amine
CID 16584672
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
1-ethyl-N-(furan-2-ylmethyl)-3-methylpyrazol-4-amine
CID 19626815
N-(furan-2-ylmethyl)pyrimidin-2-amine
CID 28514232
N-(furan-2-ylmethyl)-1,3-dimethylpyrazolo[3,4-d]pyrimidin-4-amine
CID 110431893
2-[3-[4-[4-[5-(furan-2-ylmethylamino)-[1,2,4]triazolo[4,3-c]pyrimidin-8-yl]phenyl]piperazin-1-yl]propoxy]acetic acid
CID 154675497

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-1-methyl-8-phenylimidazo[1,5-c]pyrimidin-5-amine?
The IUPAC name of N-(furan-2-ylmethyl)-1-methyl-8-phenylimidazo[1,5-c]pyrimidin-5-amine (CID 164820330) is N-(furan-2-ylmethyl)-1-methyl-8-phenylimidazo[1,5-c]pyrimidin-5-amine.
What is the SMILES notation for N-(furan-2-ylmethyl)-1-methyl-8-phenylimidazo[1,5-c]pyrimidin-5-amine?
The canonical SMILES for N-(furan-2-ylmethyl)-1-methyl-8-phenylimidazo[1,5-c]pyrimidin-5-amine is Cc1ncn2c(NCc3ccco3)ncc(-c3ccccc3)c12.
What is the InChIKey of N-(furan-2-ylmethyl)-1-methyl-8-phenylimidazo[1,5-c]pyrimidin-5-amine?
The InChIKey is PXDBPXOVYXBLAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N4O/c1-13-17-16(14-6-3-2-4-7-14)11-20-18(22(17)12-21-13)19-10-15-8-5-9-23-15/h2-9,11-12H,10H2,1H3,(H,19,20).
What are the key properties of N-(furan-2-ylmethyl)-1-methyl-8-phenylimidazo[1,5-c]pyrimidin-5-amine?
N-(furan-2-ylmethyl)-1-methyl-8-phenylimidazo[1,5-c]pyrimidin-5-amine has a molecular weight of 304.35 g/mol, XLogP of 3.91, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-1-methyl-8-phenylimidazo[1,5-c]pyrimidin-5-amine is sourced from PubChem (CID 164820330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).