1-cyclopropyl-N-[1-(2,3-difluorophenyl)ethyl]propan-2-amine

C14H19F2N — CID 103906225

IUPAC1-cyclopropyl-N-[1-(2,3-difluorophenyl)ethyl]propan-2-amine
SMILESCC(CC1CC1)NC(C)c1cccc(F)c1F
InChIInChI=1S/C14H19F2N/c1-9(8-11-6-7-11)17-10(2)12-4-3-5-13(15)14(12)16/h3-5,9-11,17H,6-8H2,1-2H3
InChIKeyJQTLRYLBVPRDKG-UHFFFAOYSA-N
MW239.31 g/mol
LogP3.80
Rot. Bonds5

About 1-cyclopropyl-N-[1-(2,3-difluorophenyl)ethyl]propan-2-amine

1-cyclopropyl-N-[1-(2,3-difluorophenyl)ethyl]propan-2-amine (PubChem CID 103906225) has the molecular formula C14H19F2N and a molecular weight of 239.31 g/mol. Its IUPAC name is 1-cyclopropyl-N-[1-(2,3-difluorophenyl)ethyl]propan-2-amine.

Molecular Properties

Compound Name1-cyclopropyl-N-[1-(2,3-difluorophenyl)ethyl]propan-2-amine
PubChem CID103906225
Molecular FormulaC14H19F2N
Molecular Weight239.31 g/mol
Exact Mass239.15
IUPAC Name1-cyclopropyl-N-[1-(2,3-difluorophenyl)ethyl]propan-2-amine
SMILESCC(CC1CC1)NC(C)c1cccc(F)c1F
InChIInChI=1S/C14H19F2N/c1-9(8-11-6-7-11)17-10(2)12-4-3-5-13(15)14(12)16/h3-5,9-11,17H,6-8H2,1-2H3
InChIKeyJQTLRYLBVPRDKG-UHFFFAOYSA-N
XLogP3.80
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.31
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(1R)-1-(2-chlorophenyl)ethyl]-1-cyclopropylpropan-2-amine
CID 104866435
N-[(1S)-1-(2-bromophenyl)ethyl]-1-cyclopropylpropan-2-amine
CID 103906303
(1S)-2-cyclopropyl-1-(2,3-difluorophenyl)ethanamine
CID 131113466
N-[1-(2,3-difluorophenyl)ethyl]-3-methylbutan-2-amine
CID 115897219
1-cyclobutyl-N-[(1S)-1-(2-methylphenyl)ethyl]propan-2-amine
CID 113489913
N-[(1S)-1-(2-chlorophenyl)ethyl]-1-cyclobutylpropan-2-amine
CID 113489915
[2-cyclopentyl-1-(2,3-difluorophenyl)ethyl]hydrazine
CID 105299116
1-cyclopropyl-N-[1-(2,6-dichloro-3-fluorophenyl)ethyl]propan-2-amine
CID 63989941
N-[1-(2,3-difluorophenyl)ethyl]-1-(furan-2-yl)propan-2-amine
CID 103924689
[(1R)-1-(2,3-difluorophenyl)ethyl]hydrazine
CID 124510602
1-(2,3-difluorophenyl)-N-[1-(2-methoxyphenyl)ethyl]ethanamine
CID 103906175
1-cyclopropyl-N-[(1S)-1-thiophen-2-ylethyl]propan-2-amine
CID 104866462

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-[1-(2,3-difluorophenyl)ethyl]propan-2-amine?
The IUPAC name of 1-cyclopropyl-N-[1-(2,3-difluorophenyl)ethyl]propan-2-amine (CID 103906225) is 1-cyclopropyl-N-[1-(2,3-difluorophenyl)ethyl]propan-2-amine.
What is the SMILES notation for 1-cyclopropyl-N-[1-(2,3-difluorophenyl)ethyl]propan-2-amine?
The canonical SMILES for 1-cyclopropyl-N-[1-(2,3-difluorophenyl)ethyl]propan-2-amine is CC(CC1CC1)NC(C)c1cccc(F)c1F.
What is the InChIKey of 1-cyclopropyl-N-[1-(2,3-difluorophenyl)ethyl]propan-2-amine?
The InChIKey is JQTLRYLBVPRDKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19F2N/c1-9(8-11-6-7-11)17-10(2)12-4-3-5-13(15)14(12)16/h3-5,9-11,17H,6-8H2,1-2H3.
What are the key properties of 1-cyclopropyl-N-[1-(2,3-difluorophenyl)ethyl]propan-2-amine?
1-cyclopropyl-N-[1-(2,3-difluorophenyl)ethyl]propan-2-amine has a molecular weight of 239.31 g/mol, XLogP of 3.80, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-[1-(2,3-difluorophenyl)ethyl]propan-2-amine is sourced from PubChem (CID 103906225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).