N'-cyclopropyl-N-methyl-N'-(2-methylpropyl)-1-(2,4,6-trimethylphenyl)ethane-1,2-diamine

C19H32N2 — CID 63467799

IUPACN'-cyclopropyl-N-methyl-N'-(2-methylpropyl)-1-(2,4,6-trimethylphenyl)ethane-1,2-diamine
SMILESCNC(CN(CC(C)C)C1CC1)c1c(C)cc(C)cc1C
InChIInChI=1S/C19H32N2/c1-13(2)11-21(17-7-8-17)12-18(20-6)19-15(4)9-14(3)10-16(19)5/h9-10,13,17-18,20H,7-8,11-12H2,1-6H3
InChIKeyOENTWBJYKYTAFV-UHFFFAOYSA-N
MW288.48 g/mol
LogP3.99
Rot. Bonds7

About N'-cyclopropyl-N-methyl-N'-(2-methylpropyl)-1-(2,4,6-trimethylphenyl)ethane-1,2-diamine

N'-cyclopropyl-N-methyl-N'-(2-methylpropyl)-1-(2,4,6-trimethylphenyl)ethane-1,2-diamine (PubChem CID 63467799) has the molecular formula C19H32N2 and a molecular weight of 288.48 g/mol. Its IUPAC name is N'-cyclopropyl-N-methyl-N'-(2-methylpropyl)-1-(2,4,6-trimethylphenyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-cyclopropyl-N-methyl-N'-(2-methylpropyl)-1-(2,4,6-trimethylphenyl)ethane-1,2-diamine
PubChem CID63467799
Molecular FormulaC19H32N2
Molecular Weight288.48 g/mol
Exact Mass288.26
IUPAC NameN'-cyclopropyl-N-methyl-N'-(2-methylpropyl)-1-(2,4,6-trimethylphenyl)ethane-1,2-diamine
SMILESCNC(CN(CC(C)C)C1CC1)c1c(C)cc(C)cc1C
InChIInChI=1S/C19H32N2/c1-13(2)11-21(17-7-8-17)12-18(20-6)19-15(4)9-14(3)10-16(19)5/h9-10,13,17-18,20H,7-8,11-12H2,1-6H3
InChIKeyOENTWBJYKYTAFV-UHFFFAOYSA-N
XLogP3.99
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.48
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N'-ethyl-N-methyl-N'-(2-methylpropyl)-1-(2,4,6-trimethylphenyl)ethane-1,2-diamine
CID 63467905
N,4-dimethyl-1-(2,4,6-trimethylphenyl)pentan-1-amine
CID 43484222
N'-(3,3-dimethylbutan-2-yl)-N,N'-dimethyl-1-(2,4,6-trimethylphenyl)ethane-1,2-diamine
CID 63469264
N'-cyclopropyl-N-methyl-1-(2,4,6-trimethylphenyl)ethane-1,2-diamine
CID 116950599
N-methyl-2-(2-methylpropylsulfanyl)-1-(2,4,6-trimethylphenyl)ethanamine
CID 64610898
N,N'-dimethyl-N'-[(2-methylcyclopropyl)methyl]-1-(2,4,6-trimethylphenyl)ethane-1,2-diamine
CID 63880271
N-methyl-2-(3-methylbutylsulfonyl)-1-(2,4,6-trimethylphenyl)ethanamine
CID 107760379
N'-cyclopropyl-N-methyl-N'-(3-methylbutyl)-1-(3-methylphenyl)propane-1,3-diamine
CID 78944157
N-methyl-2-(2-methylpropylsulfinyl)-1-(2,4,6-trimethylphenyl)ethanamine
CID 64652449
3-cyclohexyl-N-methyl-1-(2,4,6-trimethylphenyl)propan-1-amine
CID 43484245
[4-methyl-1-(2,4,6-trimethylphenyl)pentyl]hydrazine
CID 105294214
2-(2,6-dimethylpiperidin-1-yl)-N-methyl-1-(2,4,6-trimethylphenyl)ethanamine
CID 63467280

Frequently Asked Questions

What is the IUPAC name of N'-cyclopropyl-N-methyl-N'-(2-methylpropyl)-1-(2,4,6-trimethylphenyl)ethane-1,2-diamine?
The IUPAC name of N'-cyclopropyl-N-methyl-N'-(2-methylpropyl)-1-(2,4,6-trimethylphenyl)ethane-1,2-diamine (CID 63467799) is N'-cyclopropyl-N-methyl-N'-(2-methylpropyl)-1-(2,4,6-trimethylphenyl)ethane-1,2-diamine.
What is the SMILES notation for N'-cyclopropyl-N-methyl-N'-(2-methylpropyl)-1-(2,4,6-trimethylphenyl)ethane-1,2-diamine?
The canonical SMILES for N'-cyclopropyl-N-methyl-N'-(2-methylpropyl)-1-(2,4,6-trimethylphenyl)ethane-1,2-diamine is CNC(CN(CC(C)C)C1CC1)c1c(C)cc(C)cc1C.
What is the InChIKey of N'-cyclopropyl-N-methyl-N'-(2-methylpropyl)-1-(2,4,6-trimethylphenyl)ethane-1,2-diamine?
The InChIKey is OENTWBJYKYTAFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H32N2/c1-13(2)11-21(17-7-8-17)12-18(20-6)19-15(4)9-14(3)10-16(19)5/h9-10,13,17-18,20H,7-8,11-12H2,1-6H3.
What are the key properties of N'-cyclopropyl-N-methyl-N'-(2-methylpropyl)-1-(2,4,6-trimethylphenyl)ethane-1,2-diamine?
N'-cyclopropyl-N-methyl-N'-(2-methylpropyl)-1-(2,4,6-trimethylphenyl)ethane-1,2-diamine has a molecular weight of 288.48 g/mol, XLogP of 3.99, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclopropyl-N-methyl-N'-(2-methylpropyl)-1-(2,4,6-trimethylphenyl)ethane-1,2-diamine is sourced from PubChem (CID 63467799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).