2-(5,6-dimethoxy-3,4-dihydronaphthalen-2-yl)-4,5-dihydro-1H-imidazole

C15H18N2O2 — CID 154116753

IUPAC2-(5,6-dimethoxy-3,4-dihydronaphthalen-2-yl)-4,5-dihydro-1H-imidazole
SMILESCOc1ccc2c(c1OC)CCC(C1=NCCN1)=C2
InChIInChI=1S/C15H18N2O2/c1-18-13-6-4-10-9-11(15-16-7-8-17-15)3-5-12(10)14(13)19-2/h4,6,9H,3,5,7-8H2,1-2H3,(H,16,17)
InChIKeyVVICBWDJKVRKDW-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.04
Rot. Bonds3

About 2-(5,6-dimethoxy-3,4-dihydronaphthalen-2-yl)-4,5-dihydro-1H-imidazole

2-(5,6-dimethoxy-3,4-dihydronaphthalen-2-yl)-4,5-dihydro-1H-imidazole (PubChem CID 154116753) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is 2-(5,6-dimethoxy-3,4-dihydronaphthalen-2-yl)-4,5-dihydro-1H-imidazole.

Molecular Properties

Compound Name2-(5,6-dimethoxy-3,4-dihydronaphthalen-2-yl)-4,5-dihydro-1H-imidazole
PubChem CID154116753
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC Name2-(5,6-dimethoxy-3,4-dihydronaphthalen-2-yl)-4,5-dihydro-1H-imidazole
SMILESCOc1ccc2c(c1OC)CCC(C1=NCCN1)=C2
InChIInChI=1S/C15H18N2O2/c1-18-13-6-4-10-9-11(15-16-7-8-17-15)3-5-12(10)14(13)19-2/h4,6,9H,3,5,7-8H2,1-2H3,(H,16,17)
InChIKeyVVICBWDJKVRKDW-UHFFFAOYSA-N
XLogP2.04
TPSA42.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3,4-dihydronaphthalen-2-yl)-4,5-dihydro-1H-imidazole;hydrochloride
CID 157174923
2-[(1S)-5,6-dimethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]-4,5-dihydro-1H-imidazole
CID 129362563
2-methoxy-1-propan-2-yloxy-6-(3,4,5-trimethoxyphenyl)-8,9-dihydro-7H-benzo[7]annulene
CID 68923240
2-[4-[3-[4-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxyphenoxy]propoxy]-3-methoxyphenyl]-4,5-dihydro-1H-imidazole;dihydrochloride
CID 90664413
2-[4-[4-[4-(4,5-dihydro-1H-imidazol-2-yl)-2-methoxyphenoxy]butoxy]-3-methoxyphenyl]-4,5-dihydro-1H-imidazole;dihydrochloride
CID 90664911
2-(3,5-dimethoxy-4-phenylmethoxyphenyl)-4,5-dihydro-1H-imidazole
CID 110537997
2-[3-methoxy-2-(2,2,2-trifluoroethoxy)phenyl]-4,5-dihydro-1H-imidazole
CID 82247905
2-[3-methoxy-4-[(4-methylphenyl)methoxy]phenyl]-4,5-dihydro-1H-imidazole
CID 110538768
2-[2-[2-(2,5-dimethoxyphenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazole
CID 11536881
2-[3-methoxy-4-[(2-methoxyphenyl)methoxy]phenyl]-4,5-dihydro-1H-imidazole
CID 82239905
2-[2-[(2,6-dichlorophenyl)methoxy]-3-methoxyphenyl]-4,5-dihydro-1H-imidazole
CID 82252922
2,3-dibenzoyl-2,3-dihydroxybutanedioic acid;2-(5,6-dimethoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-4,5-dihydro-1H-imidazole
CID 67107795

Frequently Asked Questions

What is the IUPAC name of 2-(5,6-dimethoxy-3,4-dihydronaphthalen-2-yl)-4,5-dihydro-1H-imidazole?
The IUPAC name of 2-(5,6-dimethoxy-3,4-dihydronaphthalen-2-yl)-4,5-dihydro-1H-imidazole (CID 154116753) is 2-(5,6-dimethoxy-3,4-dihydronaphthalen-2-yl)-4,5-dihydro-1H-imidazole.
What is the SMILES notation for 2-(5,6-dimethoxy-3,4-dihydronaphthalen-2-yl)-4,5-dihydro-1H-imidazole?
The canonical SMILES for 2-(5,6-dimethoxy-3,4-dihydronaphthalen-2-yl)-4,5-dihydro-1H-imidazole is COc1ccc2c(c1OC)CCC(C1=NCCN1)=C2.
What is the InChIKey of 2-(5,6-dimethoxy-3,4-dihydronaphthalen-2-yl)-4,5-dihydro-1H-imidazole?
The InChIKey is VVICBWDJKVRKDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-18-13-6-4-10-9-11(15-16-7-8-17-15)3-5-12(10)14(13)19-2/h4,6,9H,3,5,7-8H2,1-2H3,(H,16,17).
What are the key properties of 2-(5,6-dimethoxy-3,4-dihydronaphthalen-2-yl)-4,5-dihydro-1H-imidazole?
2-(5,6-dimethoxy-3,4-dihydronaphthalen-2-yl)-4,5-dihydro-1H-imidazole has a molecular weight of 258.32 g/mol, XLogP of 2.04, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5,6-dimethoxy-3,4-dihydronaphthalen-2-yl)-4,5-dihydro-1H-imidazole is sourced from PubChem (CID 154116753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).