6-fluoro-2-N,2-N-dipropyl-1,2,3,4-tetrahydronaphthalene-2,7-diamine

C16H25FN2 — CID 10244577

IUPAC6-fluoro-2-N,2-N-dipropyl-1,2,3,4-tetrahydronaphthalene-2,7-diamine
SMILESCCCN(CCC)C1CCc2cc(F)c(N)cc2C1
InChIInChI=1S/C16H25FN2/c1-3-7-19(8-4-2)14-6-5-12-10-15(17)16(18)11-13(12)9-14/h10-11,14H,3-9,18H2,1-2H3
InChIKeyZCWXEQRWNZXNOJ-UHFFFAOYSA-N
MW264.39 g/mol
LogP3.39
Rot. Bonds5

About 6-fluoro-2-N,2-N-dipropyl-1,2,3,4-tetrahydronaphthalene-2,7-diamine

6-fluoro-2-N,2-N-dipropyl-1,2,3,4-tetrahydronaphthalene-2,7-diamine (PubChem CID 10244577) has the molecular formula C16H25FN2 and a molecular weight of 264.39 g/mol. Its IUPAC name is 6-fluoro-2-N,2-N-dipropyl-1,2,3,4-tetrahydronaphthalene-2,7-diamine.

Molecular Properties

Compound Name6-fluoro-2-N,2-N-dipropyl-1,2,3,4-tetrahydronaphthalene-2,7-diamine
PubChem CID10244577
Molecular FormulaC16H25FN2
Molecular Weight264.39 g/mol
Exact Mass264.20
IUPAC Name6-fluoro-2-N,2-N-dipropyl-1,2,3,4-tetrahydronaphthalene-2,7-diamine
SMILESCCCN(CCC)C1CCc2cc(F)c(N)cc2C1
InChIInChI=1S/C16H25FN2/c1-3-7-19(8-4-2)14-6-5-12-10-15(17)16(18)11-13(12)9-14/h10-11,14H,3-9,18H2,1-2H3
InChIKeyZCWXEQRWNZXNOJ-UHFFFAOYSA-N
XLogP3.39
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.39
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-fluoro-2-N,2-N-dipropyl-1,2,3,4-tetrahydronaphthalene-2,7-diamine?
The IUPAC name of 6-fluoro-2-N,2-N-dipropyl-1,2,3,4-tetrahydronaphthalene-2,7-diamine (CID 10244577) is 6-fluoro-2-N,2-N-dipropyl-1,2,3,4-tetrahydronaphthalene-2,7-diamine.
What is the SMILES notation for 6-fluoro-2-N,2-N-dipropyl-1,2,3,4-tetrahydronaphthalene-2,7-diamine?
The canonical SMILES for 6-fluoro-2-N,2-N-dipropyl-1,2,3,4-tetrahydronaphthalene-2,7-diamine is CCCN(CCC)C1CCc2cc(F)c(N)cc2C1.
What is the InChIKey of 6-fluoro-2-N,2-N-dipropyl-1,2,3,4-tetrahydronaphthalene-2,7-diamine?
The InChIKey is ZCWXEQRWNZXNOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25FN2/c1-3-7-19(8-4-2)14-6-5-12-10-15(17)16(18)11-13(12)9-14/h10-11,14H,3-9,18H2,1-2H3.
What are the key properties of 6-fluoro-2-N,2-N-dipropyl-1,2,3,4-tetrahydronaphthalene-2,7-diamine?
6-fluoro-2-N,2-N-dipropyl-1,2,3,4-tetrahydronaphthalene-2,7-diamine has a molecular weight of 264.39 g/mol, XLogP of 3.39, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-2-N,2-N-dipropyl-1,2,3,4-tetrahydronaphthalene-2,7-diamine is sourced from PubChem (CID 10244577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).