[4-(3-propan-2-ylphenoxy)-3-pyridinyl]methanamine

C15H18N2O — CID 81250345

IUPAC[4-(3-propan-2-ylphenoxy)-3-pyridinyl]methanamine
SMILESCC(C)c1cccc(Oc2ccncc2CN)c1
InChIInChI=1S/C15H18N2O/c1-11(2)12-4-3-5-14(8-12)18-15-6-7-17-10-13(15)9-16/h3-8,10-11H,9,16H2,1-2H3
InChIKeyQEYQPWVVOUBFLI-UHFFFAOYSA-N
MW242.32 g/mol
LogP3.46
Rot. Bonds4

About [4-(3-propan-2-ylphenoxy)-3-pyridinyl]methanamine

[4-(3-propan-2-ylphenoxy)-3-pyridinyl]methanamine (PubChem CID 81250345) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is [4-(3-propan-2-ylphenoxy)-3-pyridinyl]methanamine.

Molecular Properties

Compound Name[4-(3-propan-2-ylphenoxy)-3-pyridinyl]methanamine
PubChem CID81250345
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name[4-(3-propan-2-ylphenoxy)-3-pyridinyl]methanamine
SMILESCC(C)c1cccc(Oc2ccncc2CN)c1
InChIInChI=1S/C15H18N2O/c1-11(2)12-4-3-5-14(8-12)18-15-6-7-17-10-13(15)9-16/h3-8,10-11H,9,16H2,1-2H3
InChIKeyQEYQPWVVOUBFLI-UHFFFAOYSA-N
XLogP3.46
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [4-(3-propan-2-ylphenoxy)-3-pyridinyl]methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(chloromethyl)-4-(3-propan-2-ylphenoxy)pyridine
CID 81233837
[6-methyl-4-(3-propan-2-ylphenoxy)-3-pyridinyl]methanamine
CID 81251268
[5-chloro-2-(3-propan-2-ylphenoxy)phenyl]methanamine
CID 63456890
3-[[3-(aminomethyl)-4-pyridinyl]oxy]-N,N-dimethylaniline
CID 81251232
[2-propan-2-yl-5-(3-propan-2-ylphenoxy)pyrimidin-4-yl]methanamine
CID 62296045
[3-(3-propan-2-ylphenoxy)phenyl]methanamine
CID 63943480
[4-(6-bromonaphthalen-2-yl)oxy-3-pyridinyl]methanamine
CID 81251221
1,3-bis(3-propan-2-ylphenoxy)benzene
CID 90260311
4-chloro-2-(chloromethyl)-1-(3-propan-2-ylphenoxy)benzene
CID 114846940
N-[[4-(3-methoxyphenoxy)-3-pyridinyl]methyl]propan-2-amine
CID 81250914
8-nitro-5-(3-propan-2-ylphenoxy)isoquinoline
CID 18226312
[4-(3-methylbutoxy)-3-pyridinyl]methanamine
CID 81255354

Frequently Asked Questions

What is the IUPAC name of [4-(3-propan-2-ylphenoxy)-3-pyridinyl]methanamine?
The IUPAC name of [4-(3-propan-2-ylphenoxy)-3-pyridinyl]methanamine (CID 81250345) is [4-(3-propan-2-ylphenoxy)-3-pyridinyl]methanamine.
What is the SMILES notation for [4-(3-propan-2-ylphenoxy)-3-pyridinyl]methanamine?
The canonical SMILES for [4-(3-propan-2-ylphenoxy)-3-pyridinyl]methanamine is CC(C)c1cccc(Oc2ccncc2CN)c1.
What is the InChIKey of [4-(3-propan-2-ylphenoxy)-3-pyridinyl]methanamine?
The InChIKey is QEYQPWVVOUBFLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-11(2)12-4-3-5-14(8-12)18-15-6-7-17-10-13(15)9-16/h3-8,10-11H,9,16H2,1-2H3.
What are the key properties of [4-(3-propan-2-ylphenoxy)-3-pyridinyl]methanamine?
[4-(3-propan-2-ylphenoxy)-3-pyridinyl]methanamine has a molecular weight of 242.32 g/mol, XLogP of 3.46, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(3-propan-2-ylphenoxy)-3-pyridinyl]methanamine is sourced from PubChem (CID 81250345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).