1-(2,5-difluorophenyl)-N-(4-methylphenyl)ethane-1,2-diamine

C15H16F2N2 — CID 65377552

IUPAC1-(2,5-difluorophenyl)-N-(4-methylphenyl)ethane-1,2-diamine
SMILESCc1ccc(NC(CN)c2cc(F)ccc2F)cc1
InChIInChI=1S/C15H16F2N2/c1-10-2-5-12(6-3-10)19-15(9-18)13-8-11(16)4-7-14(13)17/h2-8,15,19H,9,18H2,1H3
InChIKeyRCBUDCSBAFGEJI-UHFFFAOYSA-N
MW262.30 g/mol
LogP3.39
Rot. Bonds4

About 1-(2,5-difluorophenyl)-N-(4-methylphenyl)ethane-1,2-diamine

1-(2,5-difluorophenyl)-N-(4-methylphenyl)ethane-1,2-diamine (PubChem CID 65377552) has the molecular formula C15H16F2N2 and a molecular weight of 262.30 g/mol. Its IUPAC name is 1-(2,5-difluorophenyl)-N-(4-methylphenyl)ethane-1,2-diamine.

Molecular Properties

Compound Name1-(2,5-difluorophenyl)-N-(4-methylphenyl)ethane-1,2-diamine
PubChem CID65377552
Molecular FormulaC15H16F2N2
Molecular Weight262.30 g/mol
Exact Mass262.13
IUPAC Name1-(2,5-difluorophenyl)-N-(4-methylphenyl)ethane-1,2-diamine
SMILESCc1ccc(NC(CN)c2cc(F)ccc2F)cc1
InChIInChI=1S/C15H16F2N2/c1-10-2-5-12(6-3-10)19-15(9-18)13-8-11(16)4-7-14(13)17/h2-8,15,19H,9,18H2,1H3
InChIKeyRCBUDCSBAFGEJI-UHFFFAOYSA-N
XLogP3.39
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.30
LogP ≤ 53.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-chloro-4-methylphenyl)-1-(2,5-difluorophenyl)ethane-1,2-diamine
CID 104721773
1-(2,5-difluorophenyl)-N-(2-fluorophenyl)ethane-1,2-diamine
CID 65377111
2-(2,5-difluorophenyl)-2-(2,2-dimethylhydrazinyl)ethanamine
CID 83012141
1-(5-chloro-2-fluorophenyl)-N-(3-chloro-4-methylphenyl)ethane-1,2-diamine
CID 114843402
1-(2-methylphenyl)-N-(4-methylphenyl)ethane-1,2-diamine
CID 65379210
N-(3-bromo-4-fluorophenyl)-1-(5-chloro-2-fluorophenyl)ethane-1,2-diamine
CID 114843404
1-(3,4-dimethylphenyl)-N-(4-methylphenyl)ethane-1,2-diamine
CID 65377760
N-(4-bromophenyl)-1-(2-fluorophenyl)ethane-1,2-diamine
CID 65385341
1-(4-bromo-2-fluorophenyl)-N-(4-chlorophenyl)ethane-1,2-diamine
CID 65384893
1-(2,3-difluorophenyl)-N-(3-methylphenyl)ethane-1,2-diamine
CID 65377575
1-(4-chlorothiophen-2-yl)-N-(4-methylphenyl)ethane-1,2-diamine
CID 79427844
1-(2,5-difluorophenyl)-2-(4-methylphenyl)ethanol
CID 61099597

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-difluorophenyl)-N-(4-methylphenyl)ethane-1,2-diamine?
The IUPAC name of 1-(2,5-difluorophenyl)-N-(4-methylphenyl)ethane-1,2-diamine (CID 65377552) is 1-(2,5-difluorophenyl)-N-(4-methylphenyl)ethane-1,2-diamine.
What is the SMILES notation for 1-(2,5-difluorophenyl)-N-(4-methylphenyl)ethane-1,2-diamine?
The canonical SMILES for 1-(2,5-difluorophenyl)-N-(4-methylphenyl)ethane-1,2-diamine is Cc1ccc(NC(CN)c2cc(F)ccc2F)cc1.
What is the InChIKey of 1-(2,5-difluorophenyl)-N-(4-methylphenyl)ethane-1,2-diamine?
The InChIKey is RCBUDCSBAFGEJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16F2N2/c1-10-2-5-12(6-3-10)19-15(9-18)13-8-11(16)4-7-14(13)17/h2-8,15,19H,9,18H2,1H3.
What are the key properties of 1-(2,5-difluorophenyl)-N-(4-methylphenyl)ethane-1,2-diamine?
1-(2,5-difluorophenyl)-N-(4-methylphenyl)ethane-1,2-diamine has a molecular weight of 262.30 g/mol, XLogP of 3.39, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-difluorophenyl)-N-(4-methylphenyl)ethane-1,2-diamine is sourced from PubChem (CID 65377552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).