1-N,2-N,2-trimethyl-2-N-[(4-methylphenyl)methyl]propane-1,2-diamine

C14H24N2 — CID 115132783

IUPAC1-N,2-N,2-trimethyl-2-N-[(4-methylphenyl)methyl]propane-1,2-diamine
SMILESCNCC(C)(C)N(C)Cc1ccc(C)cc1
InChIInChI=1S/C14H24N2/c1-12-6-8-13(9-7-12)10-16(5)14(2,3)11-15-4/h6-9,15H,10-11H2,1-5H3
InChIKeySARAWOGHLTVXRG-UHFFFAOYSA-N
MW220.36 g/mol
LogP2.42
Rot. Bonds5

About 1-N,2-N,2-trimethyl-2-N-[(4-methylphenyl)methyl]propane-1,2-diamine

1-N,2-N,2-trimethyl-2-N-[(4-methylphenyl)methyl]propane-1,2-diamine (PubChem CID 115132783) has the molecular formula C14H24N2 and a molecular weight of 220.36 g/mol. Its IUPAC name is 1-N,2-N,2-trimethyl-2-N-[(4-methylphenyl)methyl]propane-1,2-diamine.

Molecular Properties

Compound Name1-N,2-N,2-trimethyl-2-N-[(4-methylphenyl)methyl]propane-1,2-diamine
PubChem CID115132783
Molecular FormulaC14H24N2
Molecular Weight220.36 g/mol
Exact Mass220.19
IUPAC Name1-N,2-N,2-trimethyl-2-N-[(4-methylphenyl)methyl]propane-1,2-diamine
SMILESCNCC(C)(C)N(C)Cc1ccc(C)cc1
InChIInChI=1S/C14H24N2/c1-12-6-8-13(9-7-12)10-16(5)14(2,3)11-15-4/h6-9,15H,10-11H2,1-5H3
InChIKeySARAWOGHLTVXRG-UHFFFAOYSA-N
XLogP2.42
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-[[methyl-[2-methyl-1-(methylamino)propan-2-yl]amino]methyl]-1,3-dihydrobenzimidazol-2-one
CID 115132846
1-N,2-N,2-trimethyl-2-N-[(2,4,5-trimethylphenyl)methyl]propane-1,2-diamine
CID 115132834
2-N-[2-(2,5-dimethylphenyl)ethyl]-1-N,2-N,2-trimethylpropane-1,2-diamine
CID 115132993
3-N-benzyl-1-N,3-N,3-trimethylbutane-1,3-diamine
CID 142384249
N,2-dimethyl-2-[(4-methylphenyl)methyl]butan-1-amine
CID 62723481
1-N,2-N,2-trimethyl-2-N-[2-(2-methylphenyl)ethyl]propane-1,2-diamine
CID 115133027
2-ethyl-2-N-methyl-2-N-[(4-methylphenyl)methyl]butane-1,2-diamine
CID 28798833
2,2-difluoro-N-methyl-3-(4-methylphenyl)propan-1-amine
CID 105452062
1-methyl-1-[(4-methylphenyl)methyl]hydrazine
CID 82280119
4-methyl-N,N-bis[(4-methylphenyl)methyl]aniline
CID 70930364
2-N,2-dimethyl-2-N-[(4-phenylphenyl)methyl]propane-1,2-diamine
CID 115132029
N-tert-butyl-N'-methyl-N'-[(4-methylphenyl)methyl]ethane-1,2-diamine
CID 61386535

Frequently Asked Questions

What is the IUPAC name of 1-N,2-N,2-trimethyl-2-N-[(4-methylphenyl)methyl]propane-1,2-diamine?
The IUPAC name of 1-N,2-N,2-trimethyl-2-N-[(4-methylphenyl)methyl]propane-1,2-diamine (CID 115132783) is 1-N,2-N,2-trimethyl-2-N-[(4-methylphenyl)methyl]propane-1,2-diamine.
What is the SMILES notation for 1-N,2-N,2-trimethyl-2-N-[(4-methylphenyl)methyl]propane-1,2-diamine?
The canonical SMILES for 1-N,2-N,2-trimethyl-2-N-[(4-methylphenyl)methyl]propane-1,2-diamine is CNCC(C)(C)N(C)Cc1ccc(C)cc1.
What is the InChIKey of 1-N,2-N,2-trimethyl-2-N-[(4-methylphenyl)methyl]propane-1,2-diamine?
The InChIKey is SARAWOGHLTVXRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2/c1-12-6-8-13(9-7-12)10-16(5)14(2,3)11-15-4/h6-9,15H,10-11H2,1-5H3.
What are the key properties of 1-N,2-N,2-trimethyl-2-N-[(4-methylphenyl)methyl]propane-1,2-diamine?
1-N,2-N,2-trimethyl-2-N-[(4-methylphenyl)methyl]propane-1,2-diamine has a molecular weight of 220.36 g/mol, XLogP of 2.42, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,2-N,2-trimethyl-2-N-[(4-methylphenyl)methyl]propane-1,2-diamine is sourced from PubChem (CID 115132783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).