2-cyclopropyl-1-(2,5-difluorophenyl)-N-ethylpropan-1-amine

C14H19F2N — CID 83153802

IUPAC2-cyclopropyl-1-(2,5-difluorophenyl)-N-ethylpropan-1-amine
SMILESCCNC(c1cc(F)ccc1F)C(C)C1CC1
InChIInChI=1S/C14H19F2N/c1-3-17-14(9(2)10-4-5-10)12-8-11(15)6-7-13(12)16/h6-10,14,17H,3-5H2,1-2H3
InChIKeySEEMSDNPCNFCQX-UHFFFAOYSA-N
MW239.31 g/mol
LogP3.66
Rot. Bonds5

About 2-cyclopropyl-1-(2,5-difluorophenyl)-N-ethylpropan-1-amine

2-cyclopropyl-1-(2,5-difluorophenyl)-N-ethylpropan-1-amine (PubChem CID 83153802) has the molecular formula C14H19F2N and a molecular weight of 239.31 g/mol. Its IUPAC name is 2-cyclopropyl-1-(2,5-difluorophenyl)-N-ethylpropan-1-amine.

Molecular Properties

Compound Name2-cyclopropyl-1-(2,5-difluorophenyl)-N-ethylpropan-1-amine
PubChem CID83153802
Molecular FormulaC14H19F2N
Molecular Weight239.31 g/mol
Exact Mass239.15
IUPAC Name2-cyclopropyl-1-(2,5-difluorophenyl)-N-ethylpropan-1-amine
SMILESCCNC(c1cc(F)ccc1F)C(C)C1CC1
InChIInChI=1S/C14H19F2N/c1-3-17-14(9(2)10-4-5-10)12-8-11(15)6-7-13(12)16/h6-10,14,17H,3-5H2,1-2H3
InChIKeySEEMSDNPCNFCQX-UHFFFAOYSA-N
XLogP3.66
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 ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(3-bromo-4-fluorophenyl)-2-cyclopropyl-N-ethylpropan-1-amine
CID 83155186
2-cyclopropyl-1-(2,5-difluorophenyl)propan-1-ol
CID 83148576
2-cyclopropyl-N-ethyl-1-(3-fluoro-5-methylphenyl)propan-1-amine
CID 105016424
N-[(2,5-difluorophenyl)-(oxan-4-yl)methyl]ethanamine
CID 62907060
1-(2-chloro-5-fluorophenyl)-2-cyclopropyl-N-methylpropan-1-amine
CID 105396910
6-[2-cyclopropyl-1-(ethylamino)propyl]-7-fluoro-3,4-dihydro-1H-quinolin-2-one
CID 83149790
1-(5-bromo-2-fluorophenyl)-2-cyclopropyl-N-methylpropan-1-amine
CID 105011902
2-[[cyclopropyl-(2,5-difluorophenyl)methyl]amino]acetonitrile
CID 84598890
1-(2,5-difluorophenyl)-N-ethyl-2-propan-2-yloxyethanamine
CID 79575096
2-cyclohexylsulfanyl-1-(2,5-difluorophenyl)-N-ethylethanamine
CID 65144633
N-[(2,5-difluorophenyl)-(thian-2-yl)methyl]ethanamine
CID 80626288
N-[cyclooctyl-(2,5-difluorophenyl)methyl]propan-1-amine
CID 65018553

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-1-(2,5-difluorophenyl)-N-ethylpropan-1-amine?
The IUPAC name of 2-cyclopropyl-1-(2,5-difluorophenyl)-N-ethylpropan-1-amine (CID 83153802) is 2-cyclopropyl-1-(2,5-difluorophenyl)-N-ethylpropan-1-amine.
What is the SMILES notation for 2-cyclopropyl-1-(2,5-difluorophenyl)-N-ethylpropan-1-amine?
The canonical SMILES for 2-cyclopropyl-1-(2,5-difluorophenyl)-N-ethylpropan-1-amine is CCNC(c1cc(F)ccc1F)C(C)C1CC1.
What is the InChIKey of 2-cyclopropyl-1-(2,5-difluorophenyl)-N-ethylpropan-1-amine?
The InChIKey is SEEMSDNPCNFCQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19F2N/c1-3-17-14(9(2)10-4-5-10)12-8-11(15)6-7-13(12)16/h6-10,14,17H,3-5H2,1-2H3.
What are the key properties of 2-cyclopropyl-1-(2,5-difluorophenyl)-N-ethylpropan-1-amine?
2-cyclopropyl-1-(2,5-difluorophenyl)-N-ethylpropan-1-amine has a molecular weight of 239.31 g/mol, XLogP of 3.66, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-1-(2,5-difluorophenyl)-N-ethylpropan-1-amine is sourced from PubChem (CID 83153802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).