2-methyl-N-[2-(2-methyl-5-propan-2-ylphenoxy)propyl]propan-2-amine

C17H29NO — CID 63496668

IUPAC2-methyl-N-[2-(2-methyl-5-propan-2-ylphenoxy)propyl]propan-2-amine
SMILESCc1ccc(C(C)C)cc1OC(C)CNC(C)(C)C
InChIInChI=1S/C17H29NO/c1-12(2)15-9-8-13(3)16(10-15)19-14(4)11-18-17(5,6)7/h8-10,12,14,18H,11H2,1-7H3
InChIKeyNUYMDGRUHIWSJO-UHFFFAOYSA-N
MW263.43 g/mol
LogP4.27
Rot. Bonds5

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

2-methyl-N-[2-(2-methyl-5-propan-2-ylphenoxy)propyl]propan-2-amine (PubChem CID 63496668) has the molecular formula C17H29NO and a molecular weight of 263.43 g/mol. Its IUPAC name is 2-methyl-N-[2-(2-methyl-5-propan-2-ylphenoxy)propyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[2-(2-methyl-5-propan-2-ylphenoxy)propyl]propan-2-amine
PubChem CID63496668
Molecular FormulaC17H29NO
Molecular Weight263.43 g/mol
Exact Mass263.22
IUPAC Name2-methyl-N-[2-(2-methyl-5-propan-2-ylphenoxy)propyl]propan-2-amine
SMILESCc1ccc(C(C)C)cc1OC(C)CNC(C)(C)C
InChIInChI=1S/C17H29NO/c1-12(2)15-9-8-13(3)16(10-15)19-14(4)11-18-17(5,6)7/h8-10,12,14,18H,11H2,1-7H3
InChIKeyNUYMDGRUHIWSJO-UHFFFAOYSA-N
XLogP4.27
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.43
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-methyl-5-propan-2-ylphenoxy)-N-propylpropan-1-amine
CID 62484519
2-butan-2-yloxy-1-methyl-4-propan-2-ylbenzene
CID 81005711
2-(ethylamino)-2-methyl-4-(2-methyl-5-propan-2-ylphenoxy)pentan-1-ol
CID 64811206
2-amino-2-methyl-4-(2-methyl-5-propan-2-ylphenoxy)pentan-1-ol
CID 64810374
2-amino-2-methyl-4-(2-methyl-5-propan-2-ylphenoxy)pentanenitrile
CID 64725441
2-(2-methyl-5-propan-2-ylphenoxy)-N-propylpentan-3-amine
CID 63500724
N-methyl-2-(2-methyl-5-propan-2-ylphenoxy)ethanamine
CID 61035897
N-[2-(4-bromo-3-methylphenoxy)propyl]-2-methylpropan-2-amine
CID 83140591
2-(5-bromo-2-methylphenoxy)-N-tert-butylbutan-1-amine
CID 107285816
3-methyl-2-(2-methyl-5-propan-2-ylphenoxy)-N-propylbutan-1-amine
CID 63497031
N-methyl-3-(2-methyl-5-propan-2-ylphenoxy)propan-1-amine
CID 61036143
3-amino-4,4-dimethyl-2-(2-methyl-5-propan-2-ylphenoxy)pentan-1-ol
CID 114358206

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[2-(2-methyl-5-propan-2-ylphenoxy)propyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[2-(2-methyl-5-propan-2-ylphenoxy)propyl]propan-2-amine (CID 63496668) is 2-methyl-N-[2-(2-methyl-5-propan-2-ylphenoxy)propyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[2-(2-methyl-5-propan-2-ylphenoxy)propyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[2-(2-methyl-5-propan-2-ylphenoxy)propyl]propan-2-amine is Cc1ccc(C(C)C)cc1OC(C)CNC(C)(C)C.
What is the InChIKey of 2-methyl-N-[2-(2-methyl-5-propan-2-ylphenoxy)propyl]propan-2-amine?
The InChIKey is NUYMDGRUHIWSJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29NO/c1-12(2)15-9-8-13(3)16(10-15)19-14(4)11-18-17(5,6)7/h8-10,12,14,18H,11H2,1-7H3.
What are the key properties of 2-methyl-N-[2-(2-methyl-5-propan-2-ylphenoxy)propyl]propan-2-amine?
2-methyl-N-[2-(2-methyl-5-propan-2-ylphenoxy)propyl]propan-2-amine has a molecular weight of 263.43 g/mol, XLogP of 4.27, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[2-(2-methyl-5-propan-2-ylphenoxy)propyl]propan-2-amine is sourced from PubChem (CID 63496668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).