N-methyl-N-[(2-methyl-5-propan-2-ylphenyl)methyl]propan-2-amine

C15H25N — CID 117044047

IUPACN-methyl-N-[(2-methyl-5-propan-2-ylphenyl)methyl]propan-2-amine
SMILESCc1ccc(C(C)C)cc1CN(C)C(C)C
InChIInChI=1S/C15H25N/c1-11(2)14-8-7-13(5)15(9-14)10-16(6)12(3)4/h7-9,11-12H,10H2,1-6H3
InChIKeyOJAFZYTYUVVIRV-UHFFFAOYSA-N
MW219.37 g/mol
LogP3.96
Rot. Bonds4

About N-methyl-N-[(2-methyl-5-propan-2-ylphenyl)methyl]propan-2-amine

N-methyl-N-[(2-methyl-5-propan-2-ylphenyl)methyl]propan-2-amine (PubChem CID 117044047) has the molecular formula C15H25N and a molecular weight of 219.37 g/mol. Its IUPAC name is N-methyl-N-[(2-methyl-5-propan-2-ylphenyl)methyl]propan-2-amine.

Molecular Properties

Compound NameN-methyl-N-[(2-methyl-5-propan-2-ylphenyl)methyl]propan-2-amine
PubChem CID117044047
Molecular FormulaC15H25N
Molecular Weight219.37 g/mol
Exact Mass219.20
IUPAC NameN-methyl-N-[(2-methyl-5-propan-2-ylphenyl)methyl]propan-2-amine
SMILESCc1ccc(C(C)C)cc1CN(C)C(C)C
InChIInChI=1S/C15H25N/c1-11(2)14-8-7-13(5)15(9-14)10-16(6)12(3)4/h7-9,11-12H,10H2,1-6H3
InChIKeyOJAFZYTYUVVIRV-UHFFFAOYSA-N
XLogP3.96
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.37
LogP ≤ 53.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-methyl-N-[2-(2-methyl-5-propan-2-ylphenyl)ethyl]propan-2-amine
CID 117044196
N-[(2,5-dimethylphenyl)methyl]-N-methylpropan-2-amine
CID 117043979
3-methyl-2-[methyl-[(2-methyl-5-propan-2-ylphenyl)methyl]amino]butan-1-ol
CID 115137620
N-methyl-N-[(2-methyl-5-propan-2-ylphenyl)methyl]carbamoyl chloride
CID 115194809
(2-methyl-5-propan-2-ylphenyl)methanethiol
CID 21131530
N-methyl-N-[(2-methyl-5-propan-2-ylphenyl)methyl]-2-oxopropanamide
CID 115175799
2-amino-N-methyl-N-[(2-methyl-5-propan-2-ylphenyl)methyl]propanamide
CID 115152451
1-N,2-N,2-trimethyl-1-N-[(2-methyl-5-propan-2-ylphenyl)methyl]propane-1,2-diamine
CID 115222369
2-ethyl-N'-methyl-N'-[(2-methyl-5-propan-2-ylphenyl)methyl]propane-1,3-diamine
CID 115251583
[methyl-[2-(2-methyl-5-propan-2-ylphenyl)ethyl]amino]methanethiol
CID 115228441
1-(azetidin-3-yl)-N-methyl-N-[(2-methyl-5-propan-2-ylphenyl)methyl]methanamine
CID 115207690
3-amino-N,2-dimethyl-N-[(2-methyl-5-propan-2-ylphenyl)methyl]propanamide
CID 115153748

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(2-methyl-5-propan-2-ylphenyl)methyl]propan-2-amine?
The IUPAC name of N-methyl-N-[(2-methyl-5-propan-2-ylphenyl)methyl]propan-2-amine (CID 117044047) is N-methyl-N-[(2-methyl-5-propan-2-ylphenyl)methyl]propan-2-amine.
What is the SMILES notation for N-methyl-N-[(2-methyl-5-propan-2-ylphenyl)methyl]propan-2-amine?
The canonical SMILES for N-methyl-N-[(2-methyl-5-propan-2-ylphenyl)methyl]propan-2-amine is Cc1ccc(C(C)C)cc1CN(C)C(C)C.
What is the InChIKey of N-methyl-N-[(2-methyl-5-propan-2-ylphenyl)methyl]propan-2-amine?
The InChIKey is OJAFZYTYUVVIRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N/c1-11(2)14-8-7-13(5)15(9-14)10-16(6)12(3)4/h7-9,11-12H,10H2,1-6H3.
What are the key properties of N-methyl-N-[(2-methyl-5-propan-2-ylphenyl)methyl]propan-2-amine?
N-methyl-N-[(2-methyl-5-propan-2-ylphenyl)methyl]propan-2-amine has a molecular weight of 219.37 g/mol, XLogP of 3.96, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(2-methyl-5-propan-2-ylphenyl)methyl]propan-2-amine is sourced from PubChem (CID 117044047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).