N-(4-fluorophenyl)-N'-(2-methoxyethyl)-N'-(1-methoxypropan-2-yl)ethane-1,2-diamine

C15H25FN2O2 — CID 62558387

IUPACN-(4-fluorophenyl)-N'-(2-methoxyethyl)-N'-(1-methoxypropan-2-yl)ethane-1,2-diamine
SMILESCOCCN(CCNc1ccc(F)cc1)C(C)COC
InChIInChI=1S/C15H25FN2O2/c1-13(12-20-3)18(10-11-19-2)9-8-17-15-6-4-14(16)5-7-15/h4-7,13,17H,8-12H2,1-3H3
InChIKeyWZEWXNGFIFRJDE-UHFFFAOYSA-N
MW284.38 g/mol
LogP2.22
Rot. Bonds10

About N-(4-fluorophenyl)-N'-(2-methoxyethyl)-N'-(1-methoxypropan-2-yl)ethane-1,2-diamine

N-(4-fluorophenyl)-N'-(2-methoxyethyl)-N'-(1-methoxypropan-2-yl)ethane-1,2-diamine (PubChem CID 62558387) has the molecular formula C15H25FN2O2 and a molecular weight of 284.38 g/mol. Its IUPAC name is N-(4-fluorophenyl)-N'-(2-methoxyethyl)-N'-(1-methoxypropan-2-yl)ethane-1,2-diamine.

Molecular Properties

Compound NameN-(4-fluorophenyl)-N'-(2-methoxyethyl)-N'-(1-methoxypropan-2-yl)ethane-1,2-diamine
PubChem CID62558387
Molecular FormulaC15H25FN2O2
Molecular Weight284.38 g/mol
Exact Mass284.19
IUPAC NameN-(4-fluorophenyl)-N'-(2-methoxyethyl)-N'-(1-methoxypropan-2-yl)ethane-1,2-diamine
SMILESCOCCN(CCNc1ccc(F)cc1)C(C)COC
InChIInChI=1S/C15H25FN2O2/c1-13(12-20-3)18(10-11-19-2)9-8-17-15-6-4-14(16)5-7-15/h4-7,13,17H,8-12H2,1-3H3
InChIKeyWZEWXNGFIFRJDE-UHFFFAOYSA-N
XLogP2.22
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.38
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-chlorophenyl)-N'-ethyl-N'-(1-methoxypropan-2-yl)ethane-1,2-diamine
CID 62553684
4-fluoro-N-(methoxymethyl)aniline
CID 14532460
4-fluoro-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)benzamide
CID 54978956
N'-(2-methoxyethyl)-N'-(1-methoxypropan-2-yl)-N-prop-2-enylethane-1,2-diamine
CID 62556998
N'-(1-methoxypropan-2-yl)-N'-methyl-N-phenylpropane-1,3-diamine
CID 62568765
4-fluoro-N-[2-(3-methoxypropylsulfanyl)ethyl]aniline
CID 63856173
5-fluoro-2-[[2-methoxyethyl(1-methoxypropan-2-yl)amino]methyl]benzoic acid
CID 63292652
N-ethyl-6-[[2-methoxyethyl(1-methoxypropan-2-yl)amino]methyl]pyridin-2-amine
CID 79243744
3-fluoro-5-[[2-methoxyethyl(1-methoxypropan-2-yl)amino]methyl]aniline
CID 112646083
N-[(3-bromo-5-fluorophenyl)methyl]-1-methoxy-N-(2-methoxyethyl)propan-2-amine
CID 79673320
N-[2-(2,2-difluoroethoxy)ethyl]-4-fluoroaniline
CID 82010260
N-(3-fluorophenyl)-N',N'-bis(2-methoxyethyl)ethane-1,2-diamine
CID 55089867

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-N'-(2-methoxyethyl)-N'-(1-methoxypropan-2-yl)ethane-1,2-diamine?
The IUPAC name of N-(4-fluorophenyl)-N'-(2-methoxyethyl)-N'-(1-methoxypropan-2-yl)ethane-1,2-diamine (CID 62558387) is N-(4-fluorophenyl)-N'-(2-methoxyethyl)-N'-(1-methoxypropan-2-yl)ethane-1,2-diamine.
What is the SMILES notation for N-(4-fluorophenyl)-N'-(2-methoxyethyl)-N'-(1-methoxypropan-2-yl)ethane-1,2-diamine?
The canonical SMILES for N-(4-fluorophenyl)-N'-(2-methoxyethyl)-N'-(1-methoxypropan-2-yl)ethane-1,2-diamine is COCCN(CCNc1ccc(F)cc1)C(C)COC.
What is the InChIKey of N-(4-fluorophenyl)-N'-(2-methoxyethyl)-N'-(1-methoxypropan-2-yl)ethane-1,2-diamine?
The InChIKey is WZEWXNGFIFRJDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25FN2O2/c1-13(12-20-3)18(10-11-19-2)9-8-17-15-6-4-14(16)5-7-15/h4-7,13,17H,8-12H2,1-3H3.
What are the key properties of N-(4-fluorophenyl)-N'-(2-methoxyethyl)-N'-(1-methoxypropan-2-yl)ethane-1,2-diamine?
N-(4-fluorophenyl)-N'-(2-methoxyethyl)-N'-(1-methoxypropan-2-yl)ethane-1,2-diamine has a molecular weight of 284.38 g/mol, XLogP of 2.22, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-N'-(2-methoxyethyl)-N'-(1-methoxypropan-2-yl)ethane-1,2-diamine is sourced from PubChem (CID 62558387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).