2-(2,5-difluorophenyl)-N-propylcyclopentan-1-amine

C14H19F2N — CID 62801737

IUPAC2-(2,5-difluorophenyl)-N-propylcyclopentan-1-amine
SMILESCCCNC1CCCC1c1cc(F)ccc1F
InChIInChI=1S/C14H19F2N/c1-2-8-17-14-5-3-4-11(14)12-9-10(15)6-7-13(12)16/h6-7,9,11,14,17H,2-5,8H2,1H3
InChIKeySHRLLPHDFDKNJX-UHFFFAOYSA-N
MW239.31 g/mol
LogP3.60
Rot. Bonds4

About 2-(2,5-difluorophenyl)-N-propylcyclopentan-1-amine

2-(2,5-difluorophenyl)-N-propylcyclopentan-1-amine (PubChem CID 62801737) has the molecular formula C14H19F2N and a molecular weight of 239.31 g/mol. Its IUPAC name is 2-(2,5-difluorophenyl)-N-propylcyclopentan-1-amine.

Molecular Properties

Compound Name2-(2,5-difluorophenyl)-N-propylcyclopentan-1-amine
PubChem CID62801737
Molecular FormulaC14H19F2N
Molecular Weight239.31 g/mol
Exact Mass239.15
IUPAC Name2-(2,5-difluorophenyl)-N-propylcyclopentan-1-amine
SMILESCCCNC1CCCC1c1cc(F)ccc1F
InChIInChI=1S/C14H19F2N/c1-2-8-17-14-5-3-4-11(14)12-9-10(15)6-7-13(12)16/h6-7,9,11,14,17H,2-5,8H2,1H3
InChIKeySHRLLPHDFDKNJX-UHFFFAOYSA-N
XLogP3.60
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.31
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2-cyclobutylphenyl)-N-propylcyclopentan-1-amine
CID 114605846
2-(2-chloro-5-fluorophenyl)-N-ethylcyclohexan-1-amine
CID 105395830
2-(2,5-difluorophenyl)sulfinyl-N-propylcyclohexan-1-amine
CID 64652067
2-(2,5-difluorophenyl)sulfanyl-N-propylcyclooctan-1-amine
CID 64648677
2-(2-propoxyphenyl)-N-propylcyclopentan-1-amine
CID 104662479
2-[(2,4-difluorophenyl)methyl]-N-propylcyclohexan-1-amine
CID 62197668
2-[2-(2,5-difluorophenyl)sulfinylethyl]-N-propylcyclopentan-1-amine
CID 79587610
2-[2-methyl-4-(trifluoromethyl)phenyl]-N-propylcyclohexan-1-amine
CID 102755798
2-(2,4-difluorophenyl)sulfanyl-N-propylcyclohexan-1-amine
CID 64613082
N-ethyl-2-(5-fluoro-2-methoxyphenyl)cycloheptan-1-amine
CID 82783172
2-(2,4-difluorophenyl)sulfinyl-N-propylcycloheptan-1-amine
CID 64651180
N-propyl-2-[4-(trifluoromethyl)-3-pyridinyl]cyclopentan-1-amine
CID 102708824

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-difluorophenyl)-N-propylcyclopentan-1-amine?
The IUPAC name of 2-(2,5-difluorophenyl)-N-propylcyclopentan-1-amine (CID 62801737) is 2-(2,5-difluorophenyl)-N-propylcyclopentan-1-amine.
What is the SMILES notation for 2-(2,5-difluorophenyl)-N-propylcyclopentan-1-amine?
The canonical SMILES for 2-(2,5-difluorophenyl)-N-propylcyclopentan-1-amine is CCCNC1CCCC1c1cc(F)ccc1F.
What is the InChIKey of 2-(2,5-difluorophenyl)-N-propylcyclopentan-1-amine?
The InChIKey is SHRLLPHDFDKNJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19F2N/c1-2-8-17-14-5-3-4-11(14)12-9-10(15)6-7-13(12)16/h6-7,9,11,14,17H,2-5,8H2,1H3.
What are the key properties of 2-(2,5-difluorophenyl)-N-propylcyclopentan-1-amine?
2-(2,5-difluorophenyl)-N-propylcyclopentan-1-amine has a molecular weight of 239.31 g/mol, XLogP of 3.60, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-difluorophenyl)-N-propylcyclopentan-1-amine is sourced from PubChem (CID 62801737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).