7-phenylmethoxy-5-propan-2-yloxy-1,4-dihydroquinazoline

C18H20N2O2 — CID 141088855

IUPAC7-phenylmethoxy-5-propan-2-yloxy-1,4-dihydroquinazoline
SMILESCC(C)Oc1cc(OCc2ccccc2)cc2c1CN=CN2
InChIInChI=1S/C18H20N2O2/c1-13(2)22-18-9-15(8-17-16(18)10-19-12-20-17)21-11-14-6-4-3-5-7-14/h3-9,12-13H,10-11H2,1-2H3,(H,19,20)
InChIKeyCFVILIIGUMSEKX-UHFFFAOYSA-N
MW296.37 g/mol
LogP4.01
Rot. Bonds5

About 7-phenylmethoxy-5-propan-2-yloxy-1,4-dihydroquinazoline

7-phenylmethoxy-5-propan-2-yloxy-1,4-dihydroquinazoline (PubChem CID 141088855) has the molecular formula C18H20N2O2 and a molecular weight of 296.37 g/mol. Its IUPAC name is 7-phenylmethoxy-5-propan-2-yloxy-1,4-dihydroquinazoline.

Molecular Properties

Compound Name7-phenylmethoxy-5-propan-2-yloxy-1,4-dihydroquinazoline
PubChem CID141088855
Molecular FormulaC18H20N2O2
Molecular Weight296.37 g/mol
Exact Mass296.15
IUPAC Name7-phenylmethoxy-5-propan-2-yloxy-1,4-dihydroquinazoline
SMILESCC(C)Oc1cc(OCc2ccccc2)cc2c1CN=CN2
InChIInChI=1S/C18H20N2O2/c1-13(2)22-18-9-15(8-17-16(18)10-19-12-20-17)21-11-14-6-4-3-5-7-14/h3-9,12-13H,10-11H2,1-2H3,(H,19,20)
InChIKeyCFVILIIGUMSEKX-UHFFFAOYSA-N
XLogP4.01
TPSA42.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-chloro-4-phenylmethoxy-1-propan-2-yloxybenzene
CID 50888763
6-(2,6-dimethylphenyl)-2-(4-phenylmethoxy-2-propan-2-yloxyphenyl)-1H-imidazo[4,5-b]pyridine
CID 59243146
1-ethenyl-2-methyl-3,5-bis(phenylmethoxy)benzene
CID 123206589
1-(3-methyl-1-propan-2-yloxybutan-2-yl)-4-phenylmethoxybenzene
CID 58499092
2-bromo-1,3-dimethoxy-5-phenylmethoxybenzene
CID 11186357
1,3-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]-5-(2-methylpropyl)benzene
CID 59422757
2-methyl-4,6-bis(phenylmethoxy)phenol
CID 11301646
benzyl N-[(4-ethoxy-2-propan-2-yloxyphenyl)methoxycarbonyl]carbamate
CID 138459894
1,3-difluoro-2-methyl-5-phenylmethoxybenzene;ethane
CID 142106571
1-(1-ethoxyethoxy)-3-phenylmethoxybenzene
CID 22345861
methyl 3-[(2S)-butan-2-yl]oxy-5-phenylmethoxybenzoate
CID 59127096
5-[2,4-bis(phenylmethoxy)phenyl]-2H-tetrazole;hydrate
CID 22010194

Frequently Asked Questions

What is the IUPAC name of 7-phenylmethoxy-5-propan-2-yloxy-1,4-dihydroquinazoline?
The IUPAC name of 7-phenylmethoxy-5-propan-2-yloxy-1,4-dihydroquinazoline (CID 141088855) is 7-phenylmethoxy-5-propan-2-yloxy-1,4-dihydroquinazoline.
What is the SMILES notation for 7-phenylmethoxy-5-propan-2-yloxy-1,4-dihydroquinazoline?
The canonical SMILES for 7-phenylmethoxy-5-propan-2-yloxy-1,4-dihydroquinazoline is CC(C)Oc1cc(OCc2ccccc2)cc2c1CN=CN2.
What is the InChIKey of 7-phenylmethoxy-5-propan-2-yloxy-1,4-dihydroquinazoline?
The InChIKey is CFVILIIGUMSEKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O2/c1-13(2)22-18-9-15(8-17-16(18)10-19-12-20-17)21-11-14-6-4-3-5-7-14/h3-9,12-13H,10-11H2,1-2H3,(H,19,20).
What are the key properties of 7-phenylmethoxy-5-propan-2-yloxy-1,4-dihydroquinazoline?
7-phenylmethoxy-5-propan-2-yloxy-1,4-dihydroquinazoline has a molecular weight of 296.37 g/mol, XLogP of 4.01, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-phenylmethoxy-5-propan-2-yloxy-1,4-dihydroquinazoline is sourced from PubChem (CID 141088855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).