1-[2-(3-fluorophenyl)-2-methylcyclopropyl]-N-methylmethanamine

C12H16FN — CID 62703823

IUPAC1-[2-(3-fluorophenyl)-2-methylcyclopropyl]-N-methylmethanamine
SMILESCNCC1CC1(C)c1cccc(F)c1
InChIInChI=1S/C12H16FN/c1-12(7-10(12)8-14-2)9-4-3-5-11(13)6-9/h3-6,10,14H,7-8H2,1-2H3
InChIKeyNDLPOJFRDLTAQU-UHFFFAOYSA-N
MW193.27 g/mol
LogP2.32
Rot. Bonds3

About 1-[2-(3-fluorophenyl)-2-methylcyclopropyl]-N-methylmethanamine

1-[2-(3-fluorophenyl)-2-methylcyclopropyl]-N-methylmethanamine (PubChem CID 62703823) has the molecular formula C12H16FN and a molecular weight of 193.27 g/mol. Its IUPAC name is 1-[2-(3-fluorophenyl)-2-methylcyclopropyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[2-(3-fluorophenyl)-2-methylcyclopropyl]-N-methylmethanamine
PubChem CID62703823
Molecular FormulaC12H16FN
Molecular Weight193.27 g/mol
Exact Mass193.13
IUPAC Name1-[2-(3-fluorophenyl)-2-methylcyclopropyl]-N-methylmethanamine
SMILESCNCC1CC1(C)c1cccc(F)c1
InChIInChI=1S/C12H16FN/c1-12(7-10(12)8-14-2)9-4-3-5-11(13)6-9/h3-6,10,14H,7-8H2,1-2H3
InChIKeyNDLPOJFRDLTAQU-UHFFFAOYSA-N
XLogP2.32
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.27
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

[2-(3-fluorophenyl)-2-methylcyclopropyl]methanol
CID 81358099
2-(3-fluorophenyl)-2-methylcyclopropan-1-amine
CID 62387493
(1R)-2-(3-fluorophenyl)-2-methylcyclopropan-1-amine
CID 105432735
1-[2-(3-chloro-4-fluorophenyl)-2-methylcyclopropyl]-N-methylmethanamine
CID 62704012
[2-ethyl-2-(3-fluorophenyl)cyclopropyl]methanamine
CID 114872926
N-methyl-1-(2-methyl-2-thiophen-3-ylcyclopropyl)methanamine
CID 62708529
2-(3-fluorophenyl)-2-methylcyclobutan-1-ol
CID 130118878
N-[[2-methyl-2-(3-methylphenyl)cyclopropyl]methyl]propan-1-amine
CID 62708366
N-[[2-(3-bromophenyl)-2-methylcyclopropyl]methyl]-2-methoxyethanamine
CID 55135134
N-methyl-1-(2-methyl-2-naphthalen-1-ylcyclopropyl)methanamine
CID 62704010
1-fluoro-3-(1-methylcyclopropyl)benzene
CID 90779989
1-(3-fluorophenyl)-5,5-dimethyl-4-(methylaminomethyl)pyrrolidin-2-one
CID 117023360

Frequently Asked Questions

What is the IUPAC name of 1-[2-(3-fluorophenyl)-2-methylcyclopropyl]-N-methylmethanamine?
The IUPAC name of 1-[2-(3-fluorophenyl)-2-methylcyclopropyl]-N-methylmethanamine (CID 62703823) is 1-[2-(3-fluorophenyl)-2-methylcyclopropyl]-N-methylmethanamine.
What is the SMILES notation for 1-[2-(3-fluorophenyl)-2-methylcyclopropyl]-N-methylmethanamine?
The canonical SMILES for 1-[2-(3-fluorophenyl)-2-methylcyclopropyl]-N-methylmethanamine is CNCC1CC1(C)c1cccc(F)c1.
What is the InChIKey of 1-[2-(3-fluorophenyl)-2-methylcyclopropyl]-N-methylmethanamine?
The InChIKey is NDLPOJFRDLTAQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16FN/c1-12(7-10(12)8-14-2)9-4-3-5-11(13)6-9/h3-6,10,14H,7-8H2,1-2H3.
What are the key properties of 1-[2-(3-fluorophenyl)-2-methylcyclopropyl]-N-methylmethanamine?
1-[2-(3-fluorophenyl)-2-methylcyclopropyl]-N-methylmethanamine has a molecular weight of 193.27 g/mol, XLogP of 2.32, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(3-fluorophenyl)-2-methylcyclopropyl]-N-methylmethanamine is sourced from PubChem (CID 62703823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).