1-[1-[(2-fluorophenyl)methyl]cyclopropyl]-N-methylethanamine

C13H18FN — CID 106797552

IUPAC1-[1-[(2-fluorophenyl)methyl]cyclopropyl]-N-methylethanamine
SMILESCNC(C)C1(Cc2ccccc2F)CC1
InChIInChI=1S/C13H18FN/c1-10(15-2)13(7-8-13)9-11-5-3-4-6-12(11)14/h3-6,10,15H,7-9H2,1-2H3
InChIKeyGWVRPXOWQPSQMS-UHFFFAOYSA-N
MW207.29 g/mol
LogP2.76
Rot. Bonds4

About 1-[1-[(2-fluorophenyl)methyl]cyclopropyl]-N-methylethanamine

1-[1-[(2-fluorophenyl)methyl]cyclopropyl]-N-methylethanamine (PubChem CID 106797552) has the molecular formula C13H18FN and a molecular weight of 207.29 g/mol. Its IUPAC name is 1-[1-[(2-fluorophenyl)methyl]cyclopropyl]-N-methylethanamine.

Molecular Properties

Compound Name1-[1-[(2-fluorophenyl)methyl]cyclopropyl]-N-methylethanamine
PubChem CID106797552
Molecular FormulaC13H18FN
Molecular Weight207.29 g/mol
Exact Mass207.14
IUPAC Name1-[1-[(2-fluorophenyl)methyl]cyclopropyl]-N-methylethanamine
SMILESCNC(C)C1(Cc2ccccc2F)CC1
InChIInChI=1S/C13H18FN/c1-10(15-2)13(7-8-13)9-11-5-3-4-6-12(11)14/h3-6,10,15H,7-9H2,1-2H3
InChIKeyGWVRPXOWQPSQMS-UHFFFAOYSA-N
XLogP2.76
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.29
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-methyl-1-[1-[(2-methylphenyl)methyl]cyclopropyl]ethanamine
CID 106797530
1-[1-[(2,4-dichlorophenyl)methyl]cyclopropyl]-N-methylethanamine
CID 106797533
2-[(2-fluorophenyl)methyl]-2-propan-2-ylazetidine
CID 115058741
1-[(2-fluorophenyl)methyl]-4-propan-2-ylcyclohexan-1-amine
CID 63411451
2-(2-fluorophenyl)-1-(1-methoxycyclobutyl)-N-methylethanamine
CID 116714161
(2S)-4-(2-fluorophenyl)-N-methylbutan-2-amine
CID 93424532
N-methyl-1-[1-(2-phenylsulfanylethyl)cyclopropyl]ethanamine
CID 106797623
[1-[(2-fluorophenyl)methyl]cyclopropyl]methanamine
CID 66024201
1-[(2-fluorophenyl)methyl]cyclooctan-1-amine
CID 80603906
2-[(2-fluorophenyl)methyl]-2,6-dimethyl-6-propan-2-ylmorpholine
CID 114834871
N-[[1-[(2-fluorophenyl)methyl]cyclohexyl]methyl]ethanamine
CID 62726182
3-[(2-fluorophenyl)methoxy]-N-methylbutan-2-amine
CID 63935715

Frequently Asked Questions

What is the IUPAC name of 1-[1-[(2-fluorophenyl)methyl]cyclopropyl]-N-methylethanamine?
The IUPAC name of 1-[1-[(2-fluorophenyl)methyl]cyclopropyl]-N-methylethanamine (CID 106797552) is 1-[1-[(2-fluorophenyl)methyl]cyclopropyl]-N-methylethanamine.
What is the SMILES notation for 1-[1-[(2-fluorophenyl)methyl]cyclopropyl]-N-methylethanamine?
The canonical SMILES for 1-[1-[(2-fluorophenyl)methyl]cyclopropyl]-N-methylethanamine is CNC(C)C1(Cc2ccccc2F)CC1.
What is the InChIKey of 1-[1-[(2-fluorophenyl)methyl]cyclopropyl]-N-methylethanamine?
The InChIKey is GWVRPXOWQPSQMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18FN/c1-10(15-2)13(7-8-13)9-11-5-3-4-6-12(11)14/h3-6,10,15H,7-9H2,1-2H3.
What are the key properties of 1-[1-[(2-fluorophenyl)methyl]cyclopropyl]-N-methylethanamine?
1-[1-[(2-fluorophenyl)methyl]cyclopropyl]-N-methylethanamine has a molecular weight of 207.29 g/mol, XLogP of 2.76, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[(2-fluorophenyl)methyl]cyclopropyl]-N-methylethanamine is sourced from PubChem (CID 106797552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).