N-[1-(9H-fluoren-2-yl)ethyl]-N',N'-dimethylethane-1,2-diamine

C19H24N2 — CID 16776550

IUPACN-[1-(9H-fluoren-2-yl)ethyl]-N',N'-dimethylethane-1,2-diamine
SMILESCC(NCCN(C)C)c1ccc2c(c1)Cc1ccccc1-2
InChIInChI=1S/C19H24N2/c1-14(20-10-11-21(2)3)15-8-9-19-17(12-15)13-16-6-4-5-7-18(16)19/h4-9,12,14,20H,10-11,13H2,1-3H3
InChIKeyJRGLMYZAOYZYBI-UHFFFAOYSA-N
MW280.42 g/mol
LogP3.47
Rot. Bonds5

About N-[1-(9H-fluoren-2-yl)ethyl]-N',N'-dimethylethane-1,2-diamine

N-[1-(9H-fluoren-2-yl)ethyl]-N',N'-dimethylethane-1,2-diamine (PubChem CID 16776550) has the molecular formula C19H24N2 and a molecular weight of 280.42 g/mol. Its IUPAC name is N-[1-(9H-fluoren-2-yl)ethyl]-N',N'-dimethylethane-1,2-diamine.

Molecular Properties

Compound NameN-[1-(9H-fluoren-2-yl)ethyl]-N',N'-dimethylethane-1,2-diamine
PubChem CID16776550
Molecular FormulaC19H24N2
Molecular Weight280.42 g/mol
Exact Mass280.19
IUPAC NameN-[1-(9H-fluoren-2-yl)ethyl]-N',N'-dimethylethane-1,2-diamine
SMILESCC(NCCN(C)C)c1ccc2c(c1)Cc1ccccc1-2
InChIInChI=1S/C19H24N2/c1-14(20-10-11-21(2)3)15-8-9-19-17(12-15)13-16-6-4-5-7-18(16)19/h4-9,12,14,20H,10-11,13H2,1-3H3
InChIKeyJRGLMYZAOYZYBI-UHFFFAOYSA-N
XLogP3.47
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.42
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[1-(9H-fluoren-2-yl)ethyl]-N',N'-dimethylethane-1,2-diamine?
The IUPAC name of N-[1-(9H-fluoren-2-yl)ethyl]-N',N'-dimethylethane-1,2-diamine (CID 16776550) is N-[1-(9H-fluoren-2-yl)ethyl]-N',N'-dimethylethane-1,2-diamine.
What is the SMILES notation for N-[1-(9H-fluoren-2-yl)ethyl]-N',N'-dimethylethane-1,2-diamine?
The canonical SMILES for N-[1-(9H-fluoren-2-yl)ethyl]-N',N'-dimethylethane-1,2-diamine is CC(NCCN(C)C)c1ccc2c(c1)Cc1ccccc1-2.
What is the InChIKey of N-[1-(9H-fluoren-2-yl)ethyl]-N',N'-dimethylethane-1,2-diamine?
The InChIKey is JRGLMYZAOYZYBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2/c1-14(20-10-11-21(2)3)15-8-9-19-17(12-15)13-16-6-4-5-7-18(16)19/h4-9,12,14,20H,10-11,13H2,1-3H3.
What are the key properties of N-[1-(9H-fluoren-2-yl)ethyl]-N',N'-dimethylethane-1,2-diamine?
N-[1-(9H-fluoren-2-yl)ethyl]-N',N'-dimethylethane-1,2-diamine has a molecular weight of 280.42 g/mol, XLogP of 3.47, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(9H-fluoren-2-yl)ethyl]-N',N'-dimethylethane-1,2-diamine is sourced from PubChem (CID 16776550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).