6-methyl-N-[2-(4-methylphenoxy)propyl]pyridin-2-amine

C16H20N2O — CID 133483616

IUPAC6-methyl-N-[2-(4-methylphenoxy)propyl]pyridin-2-amine
SMILESCc1ccc(OC(C)CNc2cccc(C)n2)cc1
InChIInChI=1S/C16H20N2O/c1-12-7-9-15(10-8-12)19-14(3)11-17-16-6-4-5-13(2)18-16/h4-10,14H,11H2,1-3H3,(H,17,18)
InChIKeyHZRNCDCLUMRIRC-UHFFFAOYSA-N
MW256.35 g/mol
LogP3.58
Rot. Bonds5

About 6-methyl-N-[2-(4-methylphenoxy)propyl]pyridin-2-amine

6-methyl-N-[2-(4-methylphenoxy)propyl]pyridin-2-amine (PubChem CID 133483616) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is 6-methyl-N-[2-(4-methylphenoxy)propyl]pyridin-2-amine.

Molecular Properties

Compound Name6-methyl-N-[2-(4-methylphenoxy)propyl]pyridin-2-amine
PubChem CID133483616
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC Name6-methyl-N-[2-(4-methylphenoxy)propyl]pyridin-2-amine
SMILESCc1ccc(OC(C)CNc2cccc(C)n2)cc1
InChIInChI=1S/C16H20N2O/c1-12-7-9-15(10-8-12)19-14(3)11-17-16-6-4-5-13(2)18-16/h4-10,14H,11H2,1-3H3,(H,17,18)
InChIKeyHZRNCDCLUMRIRC-UHFFFAOYSA-N
XLogP3.58
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(4-methylphenoxy)propyl]naphthalen-1-amine
CID 54795940
6-[2-(4-methoxyphenoxy)propylamino]pyridine-2-carboxylic acid
CID 122048336
ethyl 2-methyl-3-[(6-methyl-2-pyridinyl)amino]propanoate
CID 133483913
6-methyl-N-(2-methyl-3-thiophen-2-ylpropyl)pyridin-2-amine
CID 133483564
6-methyl-N-(2-thiophen-2-ylpropyl)pyridin-2-amine
CID 133483394
3,4-dimethyl-N-[2-(4-methylphenoxy)propyl]aniline
CID 46736318
(1R)-1-(3-methylphenyl)-2-[(6-methyl-2-pyridinyl)amino]ethanol
CID 99704551
1-[2-[(6-methyl-2-pyridinyl)amino]ethylamino]propan-2-ol
CID 104594292
3-(2-methoxyethoxy)-N-[2-(4-methylphenoxy)propyl]aniline
CID 54803087
N-[2-(4-methylphenoxy)propyl]-4-propoxyaniline
CID 54799010
1-[(6-methyl-2-pyridinyl)amino]-3-phenylpropan-2-ol
CID 133482915
2-cyclopropyl-N-[2-(4-methoxyphenoxy)propyl]pyrimidin-4-amine
CID 133323998

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-[2-(4-methylphenoxy)propyl]pyridin-2-amine?
The IUPAC name of 6-methyl-N-[2-(4-methylphenoxy)propyl]pyridin-2-amine (CID 133483616) is 6-methyl-N-[2-(4-methylphenoxy)propyl]pyridin-2-amine.
What is the SMILES notation for 6-methyl-N-[2-(4-methylphenoxy)propyl]pyridin-2-amine?
The canonical SMILES for 6-methyl-N-[2-(4-methylphenoxy)propyl]pyridin-2-amine is Cc1ccc(OC(C)CNc2cccc(C)n2)cc1.
What is the InChIKey of 6-methyl-N-[2-(4-methylphenoxy)propyl]pyridin-2-amine?
The InChIKey is HZRNCDCLUMRIRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c1-12-7-9-15(10-8-12)19-14(3)11-17-16-6-4-5-13(2)18-16/h4-10,14H,11H2,1-3H3,(H,17,18).
What are the key properties of 6-methyl-N-[2-(4-methylphenoxy)propyl]pyridin-2-amine?
6-methyl-N-[2-(4-methylphenoxy)propyl]pyridin-2-amine has a molecular weight of 256.35 g/mol, XLogP of 3.58, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-[2-(4-methylphenoxy)propyl]pyridin-2-amine is sourced from PubChem (CID 133483616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).