cyclopropanamine;4-fluoro-2-methoxy-1-methylbenzene

C11H16FNO — CID 145378951

IUPACcyclopropanamine;4-fluoro-2-methoxy-1-methylbenzene
SMILESCOc1cc(F)ccc1C.NC1CC1
InChIInChI=1S/C8H9FO.C3H7N/c1-6-3-4-7(9)5-8(6)10-2;4-3-1-2-3/h3-5H,1-2H3;3H,1-2,4H2
InChIKeyNYFVVPYMQBLLDH-UHFFFAOYSA-N
MW197.25 g/mol
LogP2.25
Rot. Bonds1

About cyclopropanamine;4-fluoro-2-methoxy-1-methylbenzene

cyclopropanamine;4-fluoro-2-methoxy-1-methylbenzene (PubChem CID 145378951) has the molecular formula C11H16FNO and a molecular weight of 197.25 g/mol. Its IUPAC name is cyclopropanamine;4-fluoro-2-methoxy-1-methylbenzene.

Molecular Properties

Compound Namecyclopropanamine;4-fluoro-2-methoxy-1-methylbenzene
PubChem CID145378951
Molecular FormulaC11H16FNO
Molecular Weight197.25 g/mol
Exact Mass197.12
IUPAC Namecyclopropanamine;4-fluoro-2-methoxy-1-methylbenzene
SMILESCOc1cc(F)ccc1C.NC1CC1
InChIInChI=1S/C8H9FO.C3H7N/c1-6-3-4-7(9)5-8(6)10-2;4-3-1-2-3/h3-5H,1-2H3;3H,1-2,4H2
InChIKeyNYFVVPYMQBLLDH-UHFFFAOYSA-N
XLogP2.25
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.25
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(cyclopropylmethoxy)-4-fluoro-1-methylbenzene;propane
CID 162532018
4-fluoro-2-(4-methoxycyclohexyl)oxy-1-methylbenzene
CID 90140548
4-(4-fluorophenyl)-2-methoxy-1-methylbenzene
CID 46313029
2-(5-fluoro-2-methylphenoxy)-6-methoxy-2,3-dihydro-1H-inden-1-amine
CID 102981057
1-[3-(3-fluoro-5-methylphenyl)-5-(3-methoxy-4-methylphenyl)-4-pyridinyl]piperidin-4-amine
CID 118057706
2-cyclohexyloxy-4-fluoro-1-methylbenzene
CID 102990540
2-(5-fluoro-2-methylphenoxy)-4-propan-2-ylcyclohexan-1-amine
CID 102981024
4-[[(5-fluoro-2-methoxyphenyl)methylamino]methyl]cyclohexan-1-amine
CID 115213425
2-(4-ethylcyclohexyl)oxy-4-fluoro-1-methylbenzene
CID 102990440
ethane;4-fluoro-1-methoxy-2-methylbenzene
CID 143329013
9-(4-fluoro-2-methoxyphenyl)-9-azabicyclo[3.3.1]nonan-3-amine
CID 62714541
1-[2-(5-fluoro-2-methoxyphenyl)ethyl]piperidin-4-amine
CID 82298212

Frequently Asked Questions

What is the IUPAC name of cyclopropanamine;4-fluoro-2-methoxy-1-methylbenzene?
The IUPAC name of cyclopropanamine;4-fluoro-2-methoxy-1-methylbenzene (CID 145378951) is cyclopropanamine;4-fluoro-2-methoxy-1-methylbenzene.
What is the SMILES notation for cyclopropanamine;4-fluoro-2-methoxy-1-methylbenzene?
The canonical SMILES for cyclopropanamine;4-fluoro-2-methoxy-1-methylbenzene is COc1cc(F)ccc1C.NC1CC1.
What is the InChIKey of cyclopropanamine;4-fluoro-2-methoxy-1-methylbenzene?
The InChIKey is NYFVVPYMQBLLDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9FO.C3H7N/c1-6-3-4-7(9)5-8(6)10-2;4-3-1-2-3/h3-5H,1-2H3;3H,1-2,4H2.
What are the key properties of cyclopropanamine;4-fluoro-2-methoxy-1-methylbenzene?
cyclopropanamine;4-fluoro-2-methoxy-1-methylbenzene has a molecular weight of 197.25 g/mol, XLogP of 2.25, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropanamine;4-fluoro-2-methoxy-1-methylbenzene is sourced from PubChem (CID 145378951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).