N-(4-fluorophenyl)-N,N',2-trimethyl-2-propylpropane-1,3-diamine

C15H25FN2 — CID 62258708

IUPACN-(4-fluorophenyl)-N,N',2-trimethyl-2-propylpropane-1,3-diamine
SMILESCCCC(C)(CNC)CN(C)c1ccc(F)cc1
InChIInChI=1S/C15H25FN2/c1-5-10-15(2,11-17-3)12-18(4)14-8-6-13(16)7-9-14/h6-9,17H,5,10-12H2,1-4H3
InChIKeyRIVMWRZVOIXQFD-UHFFFAOYSA-N
MW252.38 g/mol
LogP3.29
Rot. Bonds7

About N-(4-fluorophenyl)-N,N',2-trimethyl-2-propylpropane-1,3-diamine

N-(4-fluorophenyl)-N,N',2-trimethyl-2-propylpropane-1,3-diamine (PubChem CID 62258708) has the molecular formula C15H25FN2 and a molecular weight of 252.38 g/mol. Its IUPAC name is N-(4-fluorophenyl)-N,N',2-trimethyl-2-propylpropane-1,3-diamine.

Molecular Properties

Compound NameN-(4-fluorophenyl)-N,N',2-trimethyl-2-propylpropane-1,3-diamine
PubChem CID62258708
Molecular FormulaC15H25FN2
Molecular Weight252.38 g/mol
Exact Mass252.20
IUPAC NameN-(4-fluorophenyl)-N,N',2-trimethyl-2-propylpropane-1,3-diamine
SMILESCCCC(C)(CNC)CN(C)c1ccc(F)cc1
InChIInChI=1S/C15H25FN2/c1-5-10-15(2,11-17-3)12-18(4)14-8-6-13(16)7-9-14/h6-9,17H,5,10-12H2,1-4H3
InChIKeyRIVMWRZVOIXQFD-UHFFFAOYSA-N
XLogP3.29
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.38
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-methoxyphenyl)-N,N',2-trimethyl-2-propylpropane-1,3-diamine
CID 62260445
N-tert-butyl-N',2-dimethyl-N'-(4-methylphenyl)-2-propylpropane-1,3-diamine
CID 63495185
2-ethyl-N'-(4-fluorophenyl)-N',2-dimethylpropane-1,3-diamine
CID 62259232
N,2-dimethyl-N-phenyl-N',2-dipropylpropane-1,3-diamine
CID 63483398
4-[[2-(aminomethyl)-2-methylpentyl]-methylamino]phenol
CID 62263583
N,N',2-trimethyl-N'-(2-methylbutan-2-yl)-2-propylpropane-1,3-diamine
CID 63967395
N,N',2-trimethyl-N'-[(3-methylphenyl)methyl]-2-propylpropane-1,3-diamine
CID 62271541
4-fluoro-N-methyl-N-propylaniline
CID 23197529
N',2-dimethyl-N,N,2-tripropylpropane-1,3-diamine
CID 62264130
N-[1-(dimethylamino)propan-2-yl]-N-ethyl-N',2-dimethyl-2-propylpropane-1,3-diamine
CID 103191300
N-butyl-4-fluoro-N-methylaniline
CID 70573878
2-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]-N,2-dimethylpentan-1-amine
CID 66362244

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-N,N',2-trimethyl-2-propylpropane-1,3-diamine?
The IUPAC name of N-(4-fluorophenyl)-N,N',2-trimethyl-2-propylpropane-1,3-diamine (CID 62258708) is N-(4-fluorophenyl)-N,N',2-trimethyl-2-propylpropane-1,3-diamine.
What is the SMILES notation for N-(4-fluorophenyl)-N,N',2-trimethyl-2-propylpropane-1,3-diamine?
The canonical SMILES for N-(4-fluorophenyl)-N,N',2-trimethyl-2-propylpropane-1,3-diamine is CCCC(C)(CNC)CN(C)c1ccc(F)cc1.
What is the InChIKey of N-(4-fluorophenyl)-N,N',2-trimethyl-2-propylpropane-1,3-diamine?
The InChIKey is RIVMWRZVOIXQFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25FN2/c1-5-10-15(2,11-17-3)12-18(4)14-8-6-13(16)7-9-14/h6-9,17H,5,10-12H2,1-4H3.
What are the key properties of N-(4-fluorophenyl)-N,N',2-trimethyl-2-propylpropane-1,3-diamine?
N-(4-fluorophenyl)-N,N',2-trimethyl-2-propylpropane-1,3-diamine has a molecular weight of 252.38 g/mol, XLogP of 3.29, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-N,N',2-trimethyl-2-propylpropane-1,3-diamine is sourced from PubChem (CID 62258708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).