1,2-dimethyl-3-propan-2-ylbenzene;N-methylmethanamine

C13H23N — CID 143062777

IUPAC1,2-dimethyl-3-propan-2-ylbenzene;N-methylmethanamine
SMILESCNC.Cc1cccc(C(C)C)c1C
InChIInChI=1S/C11H16.C2H7N/c1-8(2)11-7-5-6-9(3)10(11)4;1-3-2/h5-8H,1-4H3;3H,1-2H3
InChIKeyCGXFFKBIWFLXAT-UHFFFAOYSA-N
MW193.33 g/mol
LogP3.26
Rot. Bonds1

About 1,2-dimethyl-3-propan-2-ylbenzene;N-methylmethanamine

1,2-dimethyl-3-propan-2-ylbenzene;N-methylmethanamine (PubChem CID 143062777) has the molecular formula C13H23N and a molecular weight of 193.33 g/mol. Its IUPAC name is 1,2-dimethyl-3-propan-2-ylbenzene;N-methylmethanamine.

Molecular Properties

Compound Name1,2-dimethyl-3-propan-2-ylbenzene;N-methylmethanamine
PubChem CID143062777
Molecular FormulaC13H23N
Molecular Weight193.33 g/mol
Exact Mass193.18
IUPAC Name1,2-dimethyl-3-propan-2-ylbenzene;N-methylmethanamine
SMILESCNC.Cc1cccc(C(C)C)c1C
InChIInChI=1S/C11H16.C2H7N/c1-8(2)11-7-5-6-9(3)10(11)4;1-3-2/h5-8H,1-4H3;3H,1-2H3
InChIKeyCGXFFKBIWFLXAT-UHFFFAOYSA-N
XLogP3.26
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.33
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1,2-dimethyl-3-propan-2-ylbenzene;N-methylmethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1,2-dimethyl-3-propan-2-ylbenzene;1,2-dimethyl-4-propan-2-ylbenzene;methane
CID 142540260
N-[1-(2,3-dimethylphenyl)ethyl]propan-2-amine
CID 115705431
ethene;methane;2-methyl-1,3-di(propan-2-yl)benzene
CID 142526423
1-methyl-2-propan-2-ylbenzene;2-methyl-3-propan-2-ylphenol
CID 159173733
1,2-dimethyl-3-(1-methylsulfanylethyl)benzene
CID 86182436
1-(2,3-dimethylphenyl)-2-methylpropan-1-ol
CID 22486887
benzene;1,2,3-trimethylbenzene
CID 159605245
ethane;1,2,3-trimethylbenzene
CID 54068667
2-methyl-6-propan-2-ylaniline
CID 162117439
1-[chloro-(4-propan-2-ylphenyl)methyl]-2,3-dimethylbenzene
CID 63435435
1-isocyano-2-methyl-3-propan-2-ylbenzene
CID 162773698
1-(2,3-dimethylphenyl)-N-methyl-2-(4-propan-2-ylphenyl)ethanamine
CID 115844094

Frequently Asked Questions

What is the IUPAC name of 1,2-dimethyl-3-propan-2-ylbenzene;N-methylmethanamine?
The IUPAC name of 1,2-dimethyl-3-propan-2-ylbenzene;N-methylmethanamine (CID 143062777) is 1,2-dimethyl-3-propan-2-ylbenzene;N-methylmethanamine.
What is the SMILES notation for 1,2-dimethyl-3-propan-2-ylbenzene;N-methylmethanamine?
The canonical SMILES for 1,2-dimethyl-3-propan-2-ylbenzene;N-methylmethanamine is CNC.Cc1cccc(C(C)C)c1C.
What is the InChIKey of 1,2-dimethyl-3-propan-2-ylbenzene;N-methylmethanamine?
The InChIKey is CGXFFKBIWFLXAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16.C2H7N/c1-8(2)11-7-5-6-9(3)10(11)4;1-3-2/h5-8H,1-4H3;3H,1-2H3.
What are the key properties of 1,2-dimethyl-3-propan-2-ylbenzene;N-methylmethanamine?
1,2-dimethyl-3-propan-2-ylbenzene;N-methylmethanamine has a molecular weight of 193.33 g/mol, XLogP of 3.26, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dimethyl-3-propan-2-ylbenzene;N-methylmethanamine is sourced from PubChem (CID 143062777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).