N,N',2,2-tetramethyl-N'-[(2-methylphenyl)methyl]propane-1,3-diamine

C15H26N2 — CID 62260003

IUPACN,N',2,2-tetramethyl-N'-[(2-methylphenyl)methyl]propane-1,3-diamine
SMILESCNCC(C)(C)CN(C)Cc1ccccc1C
InChIInChI=1S/C15H26N2/c1-13-8-6-7-9-14(13)10-17(5)12-15(2,3)11-16-4/h6-9,16H,10-12H2,1-5H3
InChIKeyZKVXTIBOVCLDOR-UHFFFAOYSA-N
MW234.39 g/mol
LogP2.67
Rot. Bonds6

About N,N',2,2-tetramethyl-N'-[(2-methylphenyl)methyl]propane-1,3-diamine

N,N',2,2-tetramethyl-N'-[(2-methylphenyl)methyl]propane-1,3-diamine (PubChem CID 62260003) has the molecular formula C15H26N2 and a molecular weight of 234.39 g/mol. Its IUPAC name is N,N',2,2-tetramethyl-N'-[(2-methylphenyl)methyl]propane-1,3-diamine.

Molecular Properties

Compound NameN,N',2,2-tetramethyl-N'-[(2-methylphenyl)methyl]propane-1,3-diamine
PubChem CID62260003
Molecular FormulaC15H26N2
Molecular Weight234.39 g/mol
Exact Mass234.21
IUPAC NameN,N',2,2-tetramethyl-N'-[(2-methylphenyl)methyl]propane-1,3-diamine
SMILESCNCC(C)(C)CN(C)Cc1ccccc1C
InChIInChI=1S/C15H26N2/c1-13-8-6-7-9-14(13)10-17(5)12-15(2,3)11-16-4/h6-9,16H,10-12H2,1-5H3
InChIKeyZKVXTIBOVCLDOR-UHFFFAOYSA-N
XLogP2.67
TPSA15.27 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 ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2-chlorophenyl)methyl]-N,N',2,2-tetramethylpropane-1,3-diamine
CID 55056456
2,2-dimethyl-3-[methyl-[(2-methylphenyl)methyl]amino]propan-1-ol
CID 62267045
N,2-diethyl-N',2-dimethyl-N'-[(2-methylphenyl)methyl]propane-1,3-diamine
CID 62260863
N-methyl-2-[2-[[methyl-[(2-methylphenyl)methyl]amino]methyl]phenyl]ethanamine
CID 115463972
1-N,2-N,2-trimethyl-2-N-[2-(2-methylphenyl)ethyl]propane-1,2-diamine
CID 115133027
2-methyl-2-[[methyl-[(2-methylphenyl)methyl]amino]methyl]pentanal
CID 55052035
N-[(2-chlorophenyl)methyl]-N,2,2-trimethyl-N'-propan-2-ylpropane-1,3-diamine
CID 62272453
N-[(2-fluorophenyl)methyl]-N,2,2-trimethyl-N'-propylpropane-1,3-diamine
CID 62260843
1-N,3,3-trimethyl-1-N-[(2-methylphenyl)methyl]butane-1,2-diamine
CID 61412120
N-methyl-1-[3-[[methyl-[(2-methylphenyl)methyl]amino]methyl]furan-2-yl]methanamine
CID 62461527
N,N',2,2-tetramethyl-N'-[(2-methyl-1,3-thiazol-4-yl)methyl]propane-1,3-diamine
CID 62255905
N-tert-butyl-N'-methyl-2-methylidene-N'-[(2-methylphenyl)methyl]propane-1,3-diamine
CID 103069590

Frequently Asked Questions

What is the IUPAC name of N,N',2,2-tetramethyl-N'-[(2-methylphenyl)methyl]propane-1,3-diamine?
The IUPAC name of N,N',2,2-tetramethyl-N'-[(2-methylphenyl)methyl]propane-1,3-diamine (CID 62260003) is N,N',2,2-tetramethyl-N'-[(2-methylphenyl)methyl]propane-1,3-diamine.
What is the SMILES notation for N,N',2,2-tetramethyl-N'-[(2-methylphenyl)methyl]propane-1,3-diamine?
The canonical SMILES for N,N',2,2-tetramethyl-N'-[(2-methylphenyl)methyl]propane-1,3-diamine is CNCC(C)(C)CN(C)Cc1ccccc1C.
What is the InChIKey of N,N',2,2-tetramethyl-N'-[(2-methylphenyl)methyl]propane-1,3-diamine?
The InChIKey is ZKVXTIBOVCLDOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2/c1-13-8-6-7-9-14(13)10-17(5)12-15(2,3)11-16-4/h6-9,16H,10-12H2,1-5H3.
What are the key properties of N,N',2,2-tetramethyl-N'-[(2-methylphenyl)methyl]propane-1,3-diamine?
N,N',2,2-tetramethyl-N'-[(2-methylphenyl)methyl]propane-1,3-diamine has a molecular weight of 234.39 g/mol, XLogP of 2.67, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N',2,2-tetramethyl-N'-[(2-methylphenyl)methyl]propane-1,3-diamine is sourced from PubChem (CID 62260003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).