2-N,2-N,2-trimethyl-1-N-(2-phenylethyl)propane-1,2-diamine

C14H24N2 — CID 28651842

IUPAC2-N,2-N,2-trimethyl-1-N-(2-phenylethyl)propane-1,2-diamine
SMILESCN(C)C(C)(C)CNCCc1ccccc1
InChIInChI=1S/C14H24N2/c1-14(2,16(3)4)12-15-11-10-13-8-6-5-7-9-13/h5-9,15H,10-12H2,1-4H3
InChIKeyZJNZODYLSDDRHE-UHFFFAOYSA-N
MW220.36 g/mol
LogP2.16
Rot. Bonds6

About 2-N,2-N,2-trimethyl-1-N-(2-phenylethyl)propane-1,2-diamine

2-N,2-N,2-trimethyl-1-N-(2-phenylethyl)propane-1,2-diamine (PubChem CID 28651842) has the molecular formula C14H24N2 and a molecular weight of 220.36 g/mol. Its IUPAC name is 2-N,2-N,2-trimethyl-1-N-(2-phenylethyl)propane-1,2-diamine.

Molecular Properties

Compound Name2-N,2-N,2-trimethyl-1-N-(2-phenylethyl)propane-1,2-diamine
PubChem CID28651842
Molecular FormulaC14H24N2
Molecular Weight220.36 g/mol
Exact Mass220.19
IUPAC Name2-N,2-N,2-trimethyl-1-N-(2-phenylethyl)propane-1,2-diamine
SMILESCN(C)C(C)(C)CNCCc1ccccc1
InChIInChI=1S/C14H24N2/c1-14(2,16(3)4)12-15-11-10-13-8-6-5-7-9-13/h5-9,15H,10-12H2,1-4H3
InChIKeyZJNZODYLSDDRHE-UHFFFAOYSA-N
XLogP2.16
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-N,2-N,2-trimethyl-1-N-(3-phenoxypropyl)propane-1,2-diamine
CID 60693914
N,N,2-trimethyl-5-phenylpentan-2-amine
CID 13178252
2,2-dimethyl-3-(2-phenylethylamino)propanamide
CID 103617251
[2-methyl-1-(2-phenylethylamino)propan-2-yl] acetate
CID 150377351
CID 177239843
CID 177239843
CID 177239842
CID 177239842
propylbenzene;N,N,2-trimethylpropan-2-amine
CID 91496276
N-methyl-2-phenylethanamine;ytterbium(3+);trifluoride
CID 175294830
N',N'-diethyl-N-(2-phenylethyl)ethane-1,2-diamine
CID 12882439
N-chloro-2-phenylethanamine
CID 18184165
N-[2-(4-methoxyphenyl)ethyl]-2-methyl-2-phenylpropan-1-amine
CID 65445010
2,2-dimethyl-5-phenyl-N-propylpentan-1-amine
CID 55107021

Frequently Asked Questions

What is the IUPAC name of 2-N,2-N,2-trimethyl-1-N-(2-phenylethyl)propane-1,2-diamine?
The IUPAC name of 2-N,2-N,2-trimethyl-1-N-(2-phenylethyl)propane-1,2-diamine (CID 28651842) is 2-N,2-N,2-trimethyl-1-N-(2-phenylethyl)propane-1,2-diamine.
What is the SMILES notation for 2-N,2-N,2-trimethyl-1-N-(2-phenylethyl)propane-1,2-diamine?
The canonical SMILES for 2-N,2-N,2-trimethyl-1-N-(2-phenylethyl)propane-1,2-diamine is CN(C)C(C)(C)CNCCc1ccccc1.
What is the InChIKey of 2-N,2-N,2-trimethyl-1-N-(2-phenylethyl)propane-1,2-diamine?
The InChIKey is ZJNZODYLSDDRHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2/c1-14(2,16(3)4)12-15-11-10-13-8-6-5-7-9-13/h5-9,15H,10-12H2,1-4H3.
What are the key properties of 2-N,2-N,2-trimethyl-1-N-(2-phenylethyl)propane-1,2-diamine?
2-N,2-N,2-trimethyl-1-N-(2-phenylethyl)propane-1,2-diamine has a molecular weight of 220.36 g/mol, XLogP of 2.16, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N,2-trimethyl-1-N-(2-phenylethyl)propane-1,2-diamine is sourced from PubChem (CID 28651842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).