N-[[4-(aminomethyl)phenyl]methyl]-N,2,4,6-tetramethylaniline

C18H24N2 — CID 115213175

IUPACN-[[4-(aminomethyl)phenyl]methyl]-N,2,4,6-tetramethylaniline
SMILESCc1cc(C)c(N(C)Cc2ccc(CN)cc2)c(C)c1
InChIInChI=1S/C18H24N2/c1-13-9-14(2)18(15(3)10-13)20(4)12-17-7-5-16(11-19)6-8-17/h5-10H,11-12,19H2,1-4H3
InChIKeyMBMWTCGXBVARCC-UHFFFAOYSA-N
MW268.40 g/mol
LogP3.71
Rot. Bonds4

About N-[[4-(aminomethyl)phenyl]methyl]-N,2,4,6-tetramethylaniline

N-[[4-(aminomethyl)phenyl]methyl]-N,2,4,6-tetramethylaniline (PubChem CID 115213175) has the molecular formula C18H24N2 and a molecular weight of 268.40 g/mol. Its IUPAC name is N-[[4-(aminomethyl)phenyl]methyl]-N,2,4,6-tetramethylaniline.

Molecular Properties

Compound NameN-[[4-(aminomethyl)phenyl]methyl]-N,2,4,6-tetramethylaniline
PubChem CID115213175
Molecular FormulaC18H24N2
Molecular Weight268.40 g/mol
Exact Mass268.19
IUPAC NameN-[[4-(aminomethyl)phenyl]methyl]-N,2,4,6-tetramethylaniline
SMILESCc1cc(C)c(N(C)Cc2ccc(CN)cc2)c(C)c1
InChIInChI=1S/C18H24N2/c1-13-9-14(2)18(15(3)10-13)20(4)12-17-7-5-16(11-19)6-8-17/h5-10H,11-12,19H2,1-4H3
InChIKeyMBMWTCGXBVARCC-UHFFFAOYSA-N
XLogP3.71
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[4-[[(2,4-dimethylphenyl)methyl-methylamino]methyl]phenyl]methanamine
CID 115213236
2-(aminomethyl)-N,6-dimethyl-N-[(3-methylphenyl)methyl]aniline
CID 107105568
4-(aminomethyl)-N-benzyl-N,2-dimethylaniline
CID 60929185
N-[[4-(aminomethyl)phenyl]methyl]-3-bromo-N,5-dimethylpyridin-2-amine
CID 105366500
4-(aminomethyl)-N-[(4-fluorophenyl)methyl]-N,2-dimethylaniline
CID 60929562
N-[[4-(aminomethyl)phenyl]methyl]-3-bromo-N-methylaniline
CID 115213189
N-[[4-(aminomethyl)phenyl]methyl]-2,5-difluoro-N-methylaniline
CID 115213176
N-[[4-(aminomethyl)phenyl]methyl]-N-methyl-2-(3-methylphenyl)ethanamine
CID 115213284
4-(aminomethyl)-2-bromo-N-methyl-N-[(3-methylphenyl)methyl]aniline
CID 82793405
4-(aminomethyl)-N-[(3-chlorophenyl)methyl]-N,2-dimethylaniline
CID 61413515
4-(aminomethyl)-N-[(4-ethylphenyl)methyl]-N,3-dimethylaniline
CID 81273319
N-[[4-(aminomethyl)phenyl]methyl]-N,3,6-trimethylpyrazin-2-amine
CID 54939164

Frequently Asked Questions

What is the IUPAC name of N-[[4-(aminomethyl)phenyl]methyl]-N,2,4,6-tetramethylaniline?
The IUPAC name of N-[[4-(aminomethyl)phenyl]methyl]-N,2,4,6-tetramethylaniline (CID 115213175) is N-[[4-(aminomethyl)phenyl]methyl]-N,2,4,6-tetramethylaniline.
What is the SMILES notation for N-[[4-(aminomethyl)phenyl]methyl]-N,2,4,6-tetramethylaniline?
The canonical SMILES for N-[[4-(aminomethyl)phenyl]methyl]-N,2,4,6-tetramethylaniline is Cc1cc(C)c(N(C)Cc2ccc(CN)cc2)c(C)c1.
What is the InChIKey of N-[[4-(aminomethyl)phenyl]methyl]-N,2,4,6-tetramethylaniline?
The InChIKey is MBMWTCGXBVARCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2/c1-13-9-14(2)18(15(3)10-13)20(4)12-17-7-5-16(11-19)6-8-17/h5-10H,11-12,19H2,1-4H3.
What are the key properties of N-[[4-(aminomethyl)phenyl]methyl]-N,2,4,6-tetramethylaniline?
N-[[4-(aminomethyl)phenyl]methyl]-N,2,4,6-tetramethylaniline has a molecular weight of 268.40 g/mol, XLogP of 3.71, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(aminomethyl)phenyl]methyl]-N,2,4,6-tetramethylaniline is sourced from PubChem (CID 115213175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).