2-N-ethyl-2-N-(2-methylpropyl)-1-phenylpropane-1,2-diamine

C15H26N2 — CID 43273646

IUPAC2-N-ethyl-2-N-(2-methylpropyl)-1-phenylpropane-1,2-diamine
SMILESCCN(CC(C)C)C(C)C(N)c1ccccc1
InChIInChI=1S/C15H26N2/c1-5-17(11-12(2)3)13(4)15(16)14-9-7-6-8-10-14/h6-10,12-13,15H,5,11,16H2,1-4H3
InChIKeyHZWAVVGBJZROJJ-UHFFFAOYSA-N
MW234.39 g/mol
LogP3.05
Rot. Bonds6

About 2-N-ethyl-2-N-(2-methylpropyl)-1-phenylpropane-1,2-diamine

2-N-ethyl-2-N-(2-methylpropyl)-1-phenylpropane-1,2-diamine (PubChem CID 43273646) has the molecular formula C15H26N2 and a molecular weight of 234.39 g/mol. Its IUPAC name is 2-N-ethyl-2-N-(2-methylpropyl)-1-phenylpropane-1,2-diamine.

Molecular Properties

Compound Name2-N-ethyl-2-N-(2-methylpropyl)-1-phenylpropane-1,2-diamine
PubChem CID43273646
Molecular FormulaC15H26N2
Molecular Weight234.39 g/mol
Exact Mass234.21
IUPAC Name2-N-ethyl-2-N-(2-methylpropyl)-1-phenylpropane-1,2-diamine
SMILESCCN(CC(C)C)C(C)C(N)c1ccccc1
InChIInChI=1S/C15H26N2/c1-5-17(11-12(2)3)13(4)15(16)14-9-7-6-8-10-14/h6-10,12-13,15H,5,11,16H2,1-4H3
InChIKeyHZWAVVGBJZROJJ-UHFFFAOYSA-N
XLogP3.05
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.39
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-N,2-N-bis(2-methylpropyl)-1-phenylpropane-1,2-diamine
CID 61377500
2-N,2-N-diethyl-1-phenylpropane-1,2-diamine
CID 16784984
2-N-ethyl-2-N-(2-ethylbutyl)-1-phenylpropane-1,2-diamine
CID 61436521
N'-ethyl-2-methyl-N'-(2-methylpropyl)-1-phenylpropane-1,3-diamine
CID 62618547
N'-butan-2-yl-N'-ethyl-2-methyl-1-phenylpropane-1,3-diamine
CID 62617195
N'-methyl-N'-(2-methylpropyl)-1,2-diphenylethane-1,2-diamine
CID 43272040
2-N-ethyl-1-(4-ethylphenyl)-2-N-(2-methylbutyl)propane-1,2-diamine
CID 79477411
2-N-ethyl-2-N-(2-ethylbutyl)-1-(4-ethylphenyl)propane-1,2-diamine
CID 63469585
N'-ethyl-1,2-diphenyl-N'-propylethane-1,2-diamine
CID 43268684
N'-ethyl-N'-(1-methoxypropan-2-yl)-2-methyl-1-phenylpropane-1,3-diamine
CID 62618075
N-ethyl-N-(2-methylpropyl)-1-phenyl-N'-propan-2-ylethane-1,2-diamine
CID 62422185
2-N-ethyl-2-N-(2-ethylbutyl)-1-phenylbutane-1,2-diamine
CID 63467588

Frequently Asked Questions

What is the IUPAC name of 2-N-ethyl-2-N-(2-methylpropyl)-1-phenylpropane-1,2-diamine?
The IUPAC name of 2-N-ethyl-2-N-(2-methylpropyl)-1-phenylpropane-1,2-diamine (CID 43273646) is 2-N-ethyl-2-N-(2-methylpropyl)-1-phenylpropane-1,2-diamine.
What is the SMILES notation for 2-N-ethyl-2-N-(2-methylpropyl)-1-phenylpropane-1,2-diamine?
The canonical SMILES for 2-N-ethyl-2-N-(2-methylpropyl)-1-phenylpropane-1,2-diamine is CCN(CC(C)C)C(C)C(N)c1ccccc1.
What is the InChIKey of 2-N-ethyl-2-N-(2-methylpropyl)-1-phenylpropane-1,2-diamine?
The InChIKey is HZWAVVGBJZROJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2/c1-5-17(11-12(2)3)13(4)15(16)14-9-7-6-8-10-14/h6-10,12-13,15H,5,11,16H2,1-4H3.
What are the key properties of 2-N-ethyl-2-N-(2-methylpropyl)-1-phenylpropane-1,2-diamine?
2-N-ethyl-2-N-(2-methylpropyl)-1-phenylpropane-1,2-diamine has a molecular weight of 234.39 g/mol, XLogP of 3.05, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-ethyl-2-N-(2-methylpropyl)-1-phenylpropane-1,2-diamine is sourced from PubChem (CID 43273646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).