4-N-ethyl-4-N-(1-methoxypropan-2-yl)-2-propan-2-yloxybenzene-1,4-diamine

C15H26N2O2 — CID 83002388

IUPAC4-N-ethyl-4-N-(1-methoxypropan-2-yl)-2-propan-2-yloxybenzene-1,4-diamine
SMILESCCN(c1ccc(N)c(OC(C)C)c1)C(C)COC
InChIInChI=1S/C15H26N2O2/c1-6-17(12(4)10-18-5)13-7-8-14(16)15(9-13)19-11(2)3/h7-9,11-12H,6,10,16H2,1-5H3
InChIKeySWGHZPHUFCDIHB-UHFFFAOYSA-N
MW266.38 g/mol
LogP2.92
Rot. Bonds7

About 4-N-ethyl-4-N-(1-methoxypropan-2-yl)-2-propan-2-yloxybenzene-1,4-diamine

4-N-ethyl-4-N-(1-methoxypropan-2-yl)-2-propan-2-yloxybenzene-1,4-diamine (PubChem CID 83002388) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is 4-N-ethyl-4-N-(1-methoxypropan-2-yl)-2-propan-2-yloxybenzene-1,4-diamine.

Molecular Properties

Compound Name4-N-ethyl-4-N-(1-methoxypropan-2-yl)-2-propan-2-yloxybenzene-1,4-diamine
PubChem CID83002388
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC Name4-N-ethyl-4-N-(1-methoxypropan-2-yl)-2-propan-2-yloxybenzene-1,4-diamine
SMILESCCN(c1ccc(N)c(OC(C)C)c1)C(C)COC
InChIInChI=1S/C15H26N2O2/c1-6-17(12(4)10-18-5)13-7-8-14(16)15(9-13)19-11(2)3/h7-9,11-12H,6,10,16H2,1-5H3
InChIKeySWGHZPHUFCDIHB-UHFFFAOYSA-N
XLogP2.92
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-N-[1-(dimethylamino)propan-2-yl]-4-N-ethyl-2-propan-2-yloxybenzene-1,4-diamine
CID 103187566
2-amino-4-[ethyl(1-methoxypropan-2-yl)amino]benzoic acid
CID 104500467
3-(4-amino-N-propan-2-yl-3-propan-2-yloxyanilino)propan-1-ol
CID 83002102
4-N-methyl-4-N-pentyl-2-propan-2-yloxybenzene-1,4-diamine
CID 83002018
1-[4-[ethyl(1-methoxypropan-2-yl)amino]-2-hydroxyphenyl]ethanone
CID 79600850
4-(2-aminoethyl)-N-ethyl-N-(1-methoxypropan-2-yl)-3-methylaniline
CID 63785848
4-(methoxymethyl)-2-propan-2-yloxyaniline
CID 154827606
4-N-(4-ethylcyclohexyl)-4-N-methyl-2-propan-2-yloxybenzene-1,4-diamine
CID 83004693
4-ethyl-2-propan-2-yloxyaniline
CID 91557957
4-(2-methoxyethylsulfanyl)-2-propan-2-yloxyaniline
CID 83002282
4-[ethyl(1-methoxypropan-2-yl)amino]benzenecarbothioamide
CID 55008853
4-N-cyclopentyl-4-N-methyl-2-propan-2-yloxybenzene-1,4-diamine
CID 83002795

Frequently Asked Questions

What is the IUPAC name of 4-N-ethyl-4-N-(1-methoxypropan-2-yl)-2-propan-2-yloxybenzene-1,4-diamine?
The IUPAC name of 4-N-ethyl-4-N-(1-methoxypropan-2-yl)-2-propan-2-yloxybenzene-1,4-diamine (CID 83002388) is 4-N-ethyl-4-N-(1-methoxypropan-2-yl)-2-propan-2-yloxybenzene-1,4-diamine.
What is the SMILES notation for 4-N-ethyl-4-N-(1-methoxypropan-2-yl)-2-propan-2-yloxybenzene-1,4-diamine?
The canonical SMILES for 4-N-ethyl-4-N-(1-methoxypropan-2-yl)-2-propan-2-yloxybenzene-1,4-diamine is CCN(c1ccc(N)c(OC(C)C)c1)C(C)COC.
What is the InChIKey of 4-N-ethyl-4-N-(1-methoxypropan-2-yl)-2-propan-2-yloxybenzene-1,4-diamine?
The InChIKey is SWGHZPHUFCDIHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-6-17(12(4)10-18-5)13-7-8-14(16)15(9-13)19-11(2)3/h7-9,11-12H,6,10,16H2,1-5H3.
What are the key properties of 4-N-ethyl-4-N-(1-methoxypropan-2-yl)-2-propan-2-yloxybenzene-1,4-diamine?
4-N-ethyl-4-N-(1-methoxypropan-2-yl)-2-propan-2-yloxybenzene-1,4-diamine has a molecular weight of 266.38 g/mol, XLogP of 2.92, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-ethyl-4-N-(1-methoxypropan-2-yl)-2-propan-2-yloxybenzene-1,4-diamine is sourced from PubChem (CID 83002388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).