3-[1-(ethylamino)ethyl]-3-fluorocyclopentan-1-amine

C9H19FN2 — CID 112565771

IUPAC3-[1-(ethylamino)ethyl]-3-fluorocyclopentan-1-amine
SMILESCCNC(C)C1(F)CCC(N)C1
InChIInChI=1S/C9H19FN2/c1-3-12-7(2)9(10)5-4-8(11)6-9/h7-8,12H,3-6,11H2,1-2H3
InChIKeyJVNIJAREINFMLF-UHFFFAOYSA-N
MW174.26 g/mol
LogP1.20
Rot. Bonds3

About 3-[1-(ethylamino)ethyl]-3-fluorocyclopentan-1-amine

3-[1-(ethylamino)ethyl]-3-fluorocyclopentan-1-amine (PubChem CID 112565771) has the molecular formula C9H19FN2 and a molecular weight of 174.26 g/mol. Its IUPAC name is 3-[1-(ethylamino)ethyl]-3-fluorocyclopentan-1-amine.

Molecular Properties

Compound Name3-[1-(ethylamino)ethyl]-3-fluorocyclopentan-1-amine
PubChem CID112565771
Molecular FormulaC9H19FN2
Molecular Weight174.26 g/mol
Exact Mass174.15
IUPAC Name3-[1-(ethylamino)ethyl]-3-fluorocyclopentan-1-amine
SMILESCCNC(C)C1(F)CCC(N)C1
InChIInChI=1S/C9H19FN2/c1-3-12-7(2)9(10)5-4-8(11)6-9/h7-8,12H,3-6,11H2,1-2H3
InChIKeyJVNIJAREINFMLF-UHFFFAOYSA-N
XLogP1.20
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.26
LogP ≤ 51.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-(ethylaminomethyl)-3-fluorocyclopentan-1-amine
CID 105431493
3-fluoro-3-pentan-3-ylcyclohexan-1-amine
CID 112567492
3-fluoro-3-[(2-methylpropylamino)methyl]cyclopentan-1-amine
CID 105443345
3-fluoro-3-pentan-2-ylcyclobutan-1-amine
CID 107889771
N-ethyl-1-(1-methoxy-4-methylcyclohexyl)ethanamine
CID 116766647
2-cyclopropyl-1-(4,4-difluorocyclohexyl)-N-ethylethanamine
CID 105152813
1-[1-(ethylamino)ethyl]-3-(2-methylpropyl)cyclohexan-1-ol
CID 107429716
1-(4,4-difluorocyclohexyl)-N-ethyl-2-methoxyethanamine
CID 105165589
3-fluoro-3-(2-methylbutyl)cyclohexan-1-amine
CID 112567368
1-(3,3-difluorocyclohexyl)-N-ethyl-2,4-dimethylpentan-1-amine
CID 114284914
3-methyl-3-(2-methylbutyl)cyclopentan-1-amine
CID 116538708
1-(4,4-difluorocyclohexyl)-2-ethoxy-N-ethylethanamine
CID 105165065

Frequently Asked Questions

What is the IUPAC name of 3-[1-(ethylamino)ethyl]-3-fluorocyclopentan-1-amine?
The IUPAC name of 3-[1-(ethylamino)ethyl]-3-fluorocyclopentan-1-amine (CID 112565771) is 3-[1-(ethylamino)ethyl]-3-fluorocyclopentan-1-amine.
What is the SMILES notation for 3-[1-(ethylamino)ethyl]-3-fluorocyclopentan-1-amine?
The canonical SMILES for 3-[1-(ethylamino)ethyl]-3-fluorocyclopentan-1-amine is CCNC(C)C1(F)CCC(N)C1.
What is the InChIKey of 3-[1-(ethylamino)ethyl]-3-fluorocyclopentan-1-amine?
The InChIKey is JVNIJAREINFMLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19FN2/c1-3-12-7(2)9(10)5-4-8(11)6-9/h7-8,12H,3-6,11H2,1-2H3.
What are the key properties of 3-[1-(ethylamino)ethyl]-3-fluorocyclopentan-1-amine?
3-[1-(ethylamino)ethyl]-3-fluorocyclopentan-1-amine has a molecular weight of 174.26 g/mol, XLogP of 1.20, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(ethylamino)ethyl]-3-fluorocyclopentan-1-amine is sourced from PubChem (CID 112565771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).