2-fluoro-N-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]aniline

C13H19FN2 — CID 115244661

IUPAC2-fluoro-N-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]aniline
SMILESCNCC1(CN(C)c2ccccc2F)CC1
InChIInChI=1S/C13H19FN2/c1-15-9-13(7-8-13)10-16(2)12-6-4-3-5-11(12)14/h3-6,15H,7-10H2,1-2H3
InChIKeyUEHJZNHGHKZXSD-UHFFFAOYSA-N
MW222.31 g/mol
LogP2.26
Rot. Bonds5

About 2-fluoro-N-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]aniline

2-fluoro-N-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]aniline (PubChem CID 115244661) has the molecular formula C13H19FN2 and a molecular weight of 222.31 g/mol. Its IUPAC name is 2-fluoro-N-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]aniline.

Molecular Properties

Compound Name2-fluoro-N-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]aniline
PubChem CID115244661
Molecular FormulaC13H19FN2
Molecular Weight222.31 g/mol
Exact Mass222.15
IUPAC Name2-fluoro-N-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]aniline
SMILESCNCC1(CN(C)c2ccccc2F)CC1
InChIInChI=1S/C13H19FN2/c1-15-9-13(7-8-13)10-16(2)12-6-4-3-5-11(12)14/h3-6,15H,7-10H2,1-2H3
InChIKeyUEHJZNHGHKZXSD-UHFFFAOYSA-N
XLogP2.26
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.31
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[1-[(tert-butylamino)methyl]cyclopentyl]methyl]-2-fluoro-N-methylaniline
CID 63495939
2,5-difluoro-N-methyl-N-[[1-(methylaminomethyl)cyclobutyl]methyl]aniline
CID 115246121
N,2-dimethyl-N-[[4-(methylaminomethyl)oxan-4-yl]methyl]aniline
CID 62391682
2-methoxy-N-methyl-N-[[3-(methylaminomethyl)oxolan-3-yl]methyl]aniline
CID 62260099
4-[(2-fluoro-N-methylanilino)methyl]oxane-4-carbaldehyde
CID 62391272
2-methoxy-N,4,5-trimethyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]aniline
CID 115244616
2-fluoro-N-methyl-N-propylaniline
CID 67818828
2-(2-fluoro-N-methylanilino)-N-hydroxyacetamide
CID 130405686
N-methyl-N-[[1-(methylaminomethyl)cyclobutyl]methyl]-1-pyridin-2-ylmethanamine
CID 115246245
2-(3,4-difluorophenyl)-N-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]ethanamine
CID 115244934
N-(2-fluorophenyl)-N,N',2-trimethyl-2-phenylpropane-1,3-diamine
CID 62260635
N-methyl-N-[[1-(methylaminomethyl)cyclobutyl]methyl]-1H-pyrrol-2-amine
CID 115246125

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]aniline?
The IUPAC name of 2-fluoro-N-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]aniline (CID 115244661) is 2-fluoro-N-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]aniline.
What is the SMILES notation for 2-fluoro-N-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]aniline?
The canonical SMILES for 2-fluoro-N-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]aniline is CNCC1(CN(C)c2ccccc2F)CC1.
What is the InChIKey of 2-fluoro-N-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]aniline?
The InChIKey is UEHJZNHGHKZXSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19FN2/c1-15-9-13(7-8-13)10-16(2)12-6-4-3-5-11(12)14/h3-6,15H,7-10H2,1-2H3.
What are the key properties of 2-fluoro-N-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]aniline?
2-fluoro-N-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]aniline has a molecular weight of 222.31 g/mol, XLogP of 2.26, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]aniline is sourced from PubChem (CID 115244661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).