N-[[2-(2,4-dimethylphenoxy)-4-pyridinyl]methyl]-2-methylpropan-2-amine

C18H24N2O — CID 62296390

IUPACN-[[2-(2,4-dimethylphenoxy)-4-pyridinyl]methyl]-2-methylpropan-2-amine
SMILESCc1ccc(Oc2cc(CNC(C)(C)C)ccn2)c(C)c1
InChIInChI=1S/C18H24N2O/c1-13-6-7-16(14(2)10-13)21-17-11-15(8-9-19-17)12-20-18(3,4)5/h6-11,20H,12H2,1-5H3
InChIKeyQMRSPFVCNDILQX-UHFFFAOYSA-N
MW284.40 g/mol
LogP4.38
Rot. Bonds4

About N-[[2-(2,4-dimethylphenoxy)-4-pyridinyl]methyl]-2-methylpropan-2-amine

N-[[2-(2,4-dimethylphenoxy)-4-pyridinyl]methyl]-2-methylpropan-2-amine (PubChem CID 62296390) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is N-[[2-(2,4-dimethylphenoxy)-4-pyridinyl]methyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[[2-(2,4-dimethylphenoxy)-4-pyridinyl]methyl]-2-methylpropan-2-amine
PubChem CID62296390
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC NameN-[[2-(2,4-dimethylphenoxy)-4-pyridinyl]methyl]-2-methylpropan-2-amine
SMILESCc1ccc(Oc2cc(CNC(C)(C)C)ccn2)c(C)c1
InChIInChI=1S/C18H24N2O/c1-13-6-7-16(14(2)10-13)21-17-11-15(8-9-19-17)12-20-18(3,4)5/h6-11,20H,12H2,1-5H3
InChIKeyQMRSPFVCNDILQX-UHFFFAOYSA-N
XLogP4.38
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 54.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[2-(4-methoxyphenoxy)-4-pyridinyl]methyl]-2-methylpropan-2-amine
CID 62321833
N-[[2-(3-chloro-2-fluorophenoxy)-4-pyridinyl]methyl]-2-methylpropan-2-amine
CID 116690064
N-[[2-(4-chloro-2-methylphenoxy)-4-pyridinyl]methyl]ethanamine
CID 62321836
N-[[2-(2-methoxy-4-methylphenoxy)-4-pyridinyl]methyl]propan-1-amine
CID 62296337
N-[[2-(3-methoxypropoxy)-4-pyridinyl]methyl]-2-methylpropan-2-amine
CID 62288778
2-(2,4-dimethylphenoxy)pyridine-4-carbonitrile
CID 24690877
N-[[6-(2-fluoro-5-methylphenoxy)-3-pyridinyl]methyl]-2-methylpropan-2-amine
CID 64853702
1-(2-methoxy-5-methylphenyl)-N-[(2-methoxy-4-pyridinyl)methyl]ethanamine
CID 62992014
N-[[6-(4-bromo-2-methylphenoxy)-3-pyridinyl]methyl]-2-methylpropan-2-amine
CID 63216590
6-(2,4-dimethylphenoxy)-N-ethylpyrimidin-4-amine
CID 80862829
N-[(2,4-dimethylphenyl)methyl]-2-methylpropan-2-amine
CID 16774947
N-[[2-(2-cyclopropylethoxy)-4-pyridinyl]methyl]-2-methylpropan-2-amine
CID 106205341

Frequently Asked Questions

What is the IUPAC name of N-[[2-(2,4-dimethylphenoxy)-4-pyridinyl]methyl]-2-methylpropan-2-amine?
The IUPAC name of N-[[2-(2,4-dimethylphenoxy)-4-pyridinyl]methyl]-2-methylpropan-2-amine (CID 62296390) is N-[[2-(2,4-dimethylphenoxy)-4-pyridinyl]methyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[[2-(2,4-dimethylphenoxy)-4-pyridinyl]methyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[[2-(2,4-dimethylphenoxy)-4-pyridinyl]methyl]-2-methylpropan-2-amine is Cc1ccc(Oc2cc(CNC(C)(C)C)ccn2)c(C)c1.
What is the InChIKey of N-[[2-(2,4-dimethylphenoxy)-4-pyridinyl]methyl]-2-methylpropan-2-amine?
The InChIKey is QMRSPFVCNDILQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-13-6-7-16(14(2)10-13)21-17-11-15(8-9-19-17)12-20-18(3,4)5/h6-11,20H,12H2,1-5H3.
What are the key properties of N-[[2-(2,4-dimethylphenoxy)-4-pyridinyl]methyl]-2-methylpropan-2-amine?
N-[[2-(2,4-dimethylphenoxy)-4-pyridinyl]methyl]-2-methylpropan-2-amine has a molecular weight of 284.40 g/mol, XLogP of 4.38, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(2,4-dimethylphenoxy)-4-pyridinyl]methyl]-2-methylpropan-2-amine is sourced from PubChem (CID 62296390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).