2-methyl-2-(3-methylphenyl)-N-(2-methylpropyl)propan-1-amine

C15H25N — CID 62595545

IUPAC2-methyl-2-(3-methylphenyl)-N-(2-methylpropyl)propan-1-amine
SMILESCc1cccc(C(C)(C)CNCC(C)C)c1
InChIInChI=1S/C15H25N/c1-12(2)10-16-11-15(4,5)14-8-6-7-13(3)9-14/h6-9,12,16H,10-11H2,1-5H3
InChIKeyAGNIKYSNYWQWMH-UHFFFAOYSA-N
MW219.37 g/mol
LogP3.52
Rot. Bonds5

About 2-methyl-2-(3-methylphenyl)-N-(2-methylpropyl)propan-1-amine

2-methyl-2-(3-methylphenyl)-N-(2-methylpropyl)propan-1-amine (PubChem CID 62595545) has the molecular formula C15H25N and a molecular weight of 219.37 g/mol. Its IUPAC name is 2-methyl-2-(3-methylphenyl)-N-(2-methylpropyl)propan-1-amine.

Molecular Properties

Compound Name2-methyl-2-(3-methylphenyl)-N-(2-methylpropyl)propan-1-amine
PubChem CID62595545
Molecular FormulaC15H25N
Molecular Weight219.37 g/mol
Exact Mass219.20
IUPAC Name2-methyl-2-(3-methylphenyl)-N-(2-methylpropyl)propan-1-amine
SMILESCc1cccc(C(C)(C)CNCC(C)C)c1
InChIInChI=1S/C15H25N/c1-12(2)10-16-11-15(4,5)14-8-6-7-13(3)9-14/h6-9,12,16H,10-11H2,1-5H3
InChIKeyAGNIKYSNYWQWMH-UHFFFAOYSA-N
XLogP3.52
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.37
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-methyl-N'-[2-methyl-2-(3-methylphenyl)propyl]propane-1,3-diamine
CID 115198955
N-tert-butyl-2-methyl-2-(3-methylphenyl)propan-1-amine
CID 62595182
2-(3,4-dimethoxyphenyl)-2-methyl-N-(2-methylpropyl)propan-1-amine
CID 62595876
2-[2-methyl-2-(3-methylphenyl)propyl]-1-(2-methylpropyl)guanidine
CID 111088072
3-[[[2-methyl-2-(3-methylphenyl)propyl]amino]methyl]cyclobutan-1-amine
CID 115214425
2,2-dimethyl-3-(3-methylphenoxy)-N-(2-methylpropyl)propan-1-amine
CID 79626708
ethyl 2-[[2-methyl-2-(3-methylphenyl)propyl]amino]acetate
CID 11334178
2-methyl-2-(2-methylphenyl)-N-(2-methylpropyl)propan-1-amine
CID 62596032
N-[[1-(aminomethyl)cyclopropyl]methyl]-2-methyl-2-(3-methylphenyl)propan-1-amine
CID 115244454
N-[2-methyl-2-(3-methylphenyl)propyl]carbamoyl bromide
CID 115194297
2-methyl-2-(3-methylphenyl)propan-1-amine
CID 47002400
4-methyl-1-N-[2-methyl-2-(3-methylphenyl)propyl]benzene-1,2-diamine
CID 115125181

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-(3-methylphenyl)-N-(2-methylpropyl)propan-1-amine?
The IUPAC name of 2-methyl-2-(3-methylphenyl)-N-(2-methylpropyl)propan-1-amine (CID 62595545) is 2-methyl-2-(3-methylphenyl)-N-(2-methylpropyl)propan-1-amine.
What is the SMILES notation for 2-methyl-2-(3-methylphenyl)-N-(2-methylpropyl)propan-1-amine?
The canonical SMILES for 2-methyl-2-(3-methylphenyl)-N-(2-methylpropyl)propan-1-amine is Cc1cccc(C(C)(C)CNCC(C)C)c1.
What is the InChIKey of 2-methyl-2-(3-methylphenyl)-N-(2-methylpropyl)propan-1-amine?
The InChIKey is AGNIKYSNYWQWMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N/c1-12(2)10-16-11-15(4,5)14-8-6-7-13(3)9-14/h6-9,12,16H,10-11H2,1-5H3.
What are the key properties of 2-methyl-2-(3-methylphenyl)-N-(2-methylpropyl)propan-1-amine?
2-methyl-2-(3-methylphenyl)-N-(2-methylpropyl)propan-1-amine has a molecular weight of 219.37 g/mol, XLogP of 3.52, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-(3-methylphenyl)-N-(2-methylpropyl)propan-1-amine is sourced from PubChem (CID 62595545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).