2-[2-methyl-6-[2-(2-methylpropoxy)phenyl]-3-pyridinyl]propan-2-amine

C19H26N2O — CID 82452952

IUPAC2-[2-methyl-6-[2-(2-methylpropoxy)phenyl]-3-pyridinyl]propan-2-amine
SMILESCc1nc(-c2ccccc2OCC(C)C)ccc1C(C)(C)N
InChIInChI=1S/C19H26N2O/c1-13(2)12-22-18-9-7-6-8-15(18)17-11-10-16(14(3)21-17)19(4,5)20/h6-11,13H,12,20H2,1-5H3
InChIKeyQZQHDGHSPZAGDM-UHFFFAOYSA-N
MW298.43 g/mol
LogP4.29
Rot. Bonds5

About 2-[2-methyl-6-[2-(2-methylpropoxy)phenyl]-3-pyridinyl]propan-2-amine

2-[2-methyl-6-[2-(2-methylpropoxy)phenyl]-3-pyridinyl]propan-2-amine (PubChem CID 82452952) has the molecular formula C19H26N2O and a molecular weight of 298.43 g/mol. Its IUPAC name is 2-[2-methyl-6-[2-(2-methylpropoxy)phenyl]-3-pyridinyl]propan-2-amine.

Molecular Properties

Compound Name2-[2-methyl-6-[2-(2-methylpropoxy)phenyl]-3-pyridinyl]propan-2-amine
PubChem CID82452952
Molecular FormulaC19H26N2O
Molecular Weight298.43 g/mol
Exact Mass298.20
IUPAC Name2-[2-methyl-6-[2-(2-methylpropoxy)phenyl]-3-pyridinyl]propan-2-amine
SMILESCc1nc(-c2ccccc2OCC(C)C)ccc1C(C)(C)N
InChIInChI=1S/C19H26N2O/c1-13(2)12-22-18-9-7-6-8-15(18)17-11-10-16(14(3)21-17)19(4,5)20/h6-11,13H,12,20H2,1-5H3
InChIKeyQZQHDGHSPZAGDM-UHFFFAOYSA-N
XLogP4.29
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.43
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[6-(2-butoxyphenyl)-2-methyl-3-pyridinyl]propan-2-amine
CID 82452933
3-(chloromethyl)-2-methyl-6-[2-(2-methylpropoxy)phenyl]pyridine
CID 82452946
6-(2-ethoxyphenyl)-2-methylpyridin-3-amine
CID 82467687
2-methyl-4-[2-(2-methylpropoxy)phenyl]-1H-pyrimidin-6-one
CID 137084101
3-[2-(2-methylpropoxy)phenyl]pyridine-2,6-diamine
CID 139370148
N-[[6-(2-ethoxyphenyl)-2-methyl-3-pyridinyl]methyl]-2-methylpropan-1-amine
CID 82452876
5,6-dimethyl-2-[2-(2-methylpropoxy)phenyl]-1H-benzimidazole
CID 110538872
[6-(2-butoxyphenyl)-2-methyl-3-pyridinyl]methanamine
CID 82452931
5-[2-(2-methylpropoxy)phenyl]thiophene-2-carboxylic acid
CID 167136873
ethyl 2-amino-4-methyl-6-[2-(2-methylpropoxy)phenyl]pyrimidine-5-carboxylate
CID 54851288
3-[2-(2-methylpropoxy)phenyl]-6-oxo-1H-pyridazine-5-carbonyl chloride
CID 82445899
ethyl 5-[2-(2-methylpropoxy)phenyl]-2H-triazole-4-carboxylate
CID 169400116

Frequently Asked Questions

What is the IUPAC name of 2-[2-methyl-6-[2-(2-methylpropoxy)phenyl]-3-pyridinyl]propan-2-amine?
The IUPAC name of 2-[2-methyl-6-[2-(2-methylpropoxy)phenyl]-3-pyridinyl]propan-2-amine (CID 82452952) is 2-[2-methyl-6-[2-(2-methylpropoxy)phenyl]-3-pyridinyl]propan-2-amine.
What is the SMILES notation for 2-[2-methyl-6-[2-(2-methylpropoxy)phenyl]-3-pyridinyl]propan-2-amine?
The canonical SMILES for 2-[2-methyl-6-[2-(2-methylpropoxy)phenyl]-3-pyridinyl]propan-2-amine is Cc1nc(-c2ccccc2OCC(C)C)ccc1C(C)(C)N.
What is the InChIKey of 2-[2-methyl-6-[2-(2-methylpropoxy)phenyl]-3-pyridinyl]propan-2-amine?
The InChIKey is QZQHDGHSPZAGDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O/c1-13(2)12-22-18-9-7-6-8-15(18)17-11-10-16(14(3)21-17)19(4,5)20/h6-11,13H,12,20H2,1-5H3.
What are the key properties of 2-[2-methyl-6-[2-(2-methylpropoxy)phenyl]-3-pyridinyl]propan-2-amine?
2-[2-methyl-6-[2-(2-methylpropoxy)phenyl]-3-pyridinyl]propan-2-amine has a molecular weight of 298.43 g/mol, XLogP of 4.29, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-methyl-6-[2-(2-methylpropoxy)phenyl]-3-pyridinyl]propan-2-amine is sourced from PubChem (CID 82452952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).