1-(2,4-dimethylphenyl)-N,N,2,2-tetramethylpropane-1,3-diamine

C15H26N2 — CID 116904924

IUPAC1-(2,4-dimethylphenyl)-N,N,2,2-tetramethylpropane-1,3-diamine
SMILESCc1ccc(C(N(C)C)C(C)(C)CN)c(C)c1
InChIInChI=1S/C15H26N2/c1-11-7-8-13(12(2)9-11)14(17(5)6)15(3,4)10-16/h7-9,14H,10,16H2,1-6H3
InChIKeyMOBANFVLNBBMQN-UHFFFAOYSA-N
MW234.39 g/mol
LogP2.89
Rot. Bonds4

About 1-(2,4-dimethylphenyl)-N,N,2,2-tetramethylpropane-1,3-diamine

1-(2,4-dimethylphenyl)-N,N,2,2-tetramethylpropane-1,3-diamine (PubChem CID 116904924) has the molecular formula C15H26N2 and a molecular weight of 234.39 g/mol. Its IUPAC name is 1-(2,4-dimethylphenyl)-N,N,2,2-tetramethylpropane-1,3-diamine.

Molecular Properties

Compound Name1-(2,4-dimethylphenyl)-N,N,2,2-tetramethylpropane-1,3-diamine
PubChem CID116904924
Molecular FormulaC15H26N2
Molecular Weight234.39 g/mol
Exact Mass234.21
IUPAC Name1-(2,4-dimethylphenyl)-N,N,2,2-tetramethylpropane-1,3-diamine
SMILESCc1ccc(C(N(C)C)C(C)(C)CN)c(C)c1
InChIInChI=1S/C15H26N2/c1-11-7-8-13(12(2)9-11)14(17(5)6)15(3,4)10-16/h7-9,14H,10,16H2,1-6H3
InChIKeyMOBANFVLNBBMQN-UHFFFAOYSA-N
XLogP2.89
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.39
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,4-dimethylphenyl)-2,2-dimethylpropane-1,3-diamine
CID 116933377
N,N,2,2-tetramethyl-1-(3-methylphenyl)propane-1,3-diamine
CID 116904978
N'-[1-(2,4-dimethylphenyl)ethyl]-N',2,2-trimethylpropane-1,3-diamine
CID 79646619
1-(2,5-dimethylphenyl)-2,2-dimethylpropane-1,3-diamine
CID 116933361
(3R)-3-amino-3-(2,4-dimethylphenyl)-2,2-dimethylpropan-1-ol
CID 131625562
2-(aminomethyl)-1-(2,4-dimethylphenyl)-2-methylbutan-1-ol
CID 79138441
1-(2,4-dimethylphenyl)-N,N-dimethyl-2-propan-2-ylpropane-1,3-diamine
CID 116913495
(1S)-1-(2,4-dimethylphenyl)-2,2-dimethylpropan-1-amine
CID 28500813
N,N,2,2-tetramethyl-1-(2,4,6-trimethylphenyl)butane-1,4-diamine
CID 116905673
3-(2,4-dimethylphenyl)-N,N-dimethylbutan-2-amine
CID 137390997
2-amino-1-(2,4-dimethylphenyl)ethanol;hydrochloride
CID 137346924
1-(4-tert-butyl-2-methylphenyl)-N,N-dimethylethane-1,2-diamine
CID 82496475

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-dimethylphenyl)-N,N,2,2-tetramethylpropane-1,3-diamine?
The IUPAC name of 1-(2,4-dimethylphenyl)-N,N,2,2-tetramethylpropane-1,3-diamine (CID 116904924) is 1-(2,4-dimethylphenyl)-N,N,2,2-tetramethylpropane-1,3-diamine.
What is the SMILES notation for 1-(2,4-dimethylphenyl)-N,N,2,2-tetramethylpropane-1,3-diamine?
The canonical SMILES for 1-(2,4-dimethylphenyl)-N,N,2,2-tetramethylpropane-1,3-diamine is Cc1ccc(C(N(C)C)C(C)(C)CN)c(C)c1.
What is the InChIKey of 1-(2,4-dimethylphenyl)-N,N,2,2-tetramethylpropane-1,3-diamine?
The InChIKey is MOBANFVLNBBMQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2/c1-11-7-8-13(12(2)9-11)14(17(5)6)15(3,4)10-16/h7-9,14H,10,16H2,1-6H3.
What are the key properties of 1-(2,4-dimethylphenyl)-N,N,2,2-tetramethylpropane-1,3-diamine?
1-(2,4-dimethylphenyl)-N,N,2,2-tetramethylpropane-1,3-diamine has a molecular weight of 234.39 g/mol, XLogP of 2.89, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dimethylphenyl)-N,N,2,2-tetramethylpropane-1,3-diamine is sourced from PubChem (CID 116904924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).