N-methyl-5-(2-phenylethoxymethyl)pyridin-2-amine

C15H18N2O — CID 114996967

IUPACN-methyl-5-(2-phenylethoxymethyl)pyridin-2-amine
SMILESCNc1ccc(COCCc2ccccc2)cn1
InChIInChI=1S/C15H18N2O/c1-16-15-8-7-14(11-17-15)12-18-10-9-13-5-3-2-4-6-13/h2-8,11H,9-10,12H2,1H3,(H,16,17)
InChIKeyQJPVXGXMCSPFRP-UHFFFAOYSA-N
MW242.32 g/mol
LogP2.88
Rot. Bonds6

About N-methyl-5-(2-phenylethoxymethyl)pyridin-2-amine

N-methyl-5-(2-phenylethoxymethyl)pyridin-2-amine (PubChem CID 114996967) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is N-methyl-5-(2-phenylethoxymethyl)pyridin-2-amine.

Molecular Properties

Compound NameN-methyl-5-(2-phenylethoxymethyl)pyridin-2-amine
PubChem CID114996967
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC NameN-methyl-5-(2-phenylethoxymethyl)pyridin-2-amine
SMILESCNc1ccc(COCCc2ccccc2)cn1
InChIInChI=1S/C15H18N2O/c1-16-15-8-7-14(11-17-15)12-18-10-9-13-5-3-2-4-6-13/h2-8,11H,9-10,12H2,1H3,(H,16,17)
InChIKeyQJPVXGXMCSPFRP-UHFFFAOYSA-N
XLogP2.88
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

5-[(2,6-dimethylphenoxy)methyl]-N-methylpyridin-2-amine
CID 62195101
N-methyl-4-(3-phenylpropoxymethyl)pyridin-2-amine
CID 62467292
N-methyl-5-(2-methylpentoxymethyl)pyridin-2-amine
CID 103285298
N-methyl-5-propylpyridin-2-amine
CID 88974517
1-butyl-4-(2-phenylmethoxyethyl)benzene
CID 137452332
5-butyl-N-methylpyridin-2-amine
CID 139696772
[5-(butoxymethyl)-2-pyridinyl]hydrazine
CID 62245667
N-[5-(2-phenylmethoxyethyl)-2-pyridinyl]-6-(1,3-thiazol-2-yl)pyridin-2-amine;dihydrochloride
CID 140526366
5-[[3-(dimethylamino)phenoxy]methyl]-N-methylpyridin-2-amine
CID 62187826
5-[(2,4-dimethylphenoxy)methyl]-N-methylpyridin-2-amine
CID 62193335
4-(2-phenylethoxymethyl)benzoic acid
CID 28994595
4-(2-phenylethoxymethyl)benzonitrile
CID 43128153

Frequently Asked Questions

What is the IUPAC name of N-methyl-5-(2-phenylethoxymethyl)pyridin-2-amine?
The IUPAC name of N-methyl-5-(2-phenylethoxymethyl)pyridin-2-amine (CID 114996967) is N-methyl-5-(2-phenylethoxymethyl)pyridin-2-amine.
What is the SMILES notation for N-methyl-5-(2-phenylethoxymethyl)pyridin-2-amine?
The canonical SMILES for N-methyl-5-(2-phenylethoxymethyl)pyridin-2-amine is CNc1ccc(COCCc2ccccc2)cn1.
What is the InChIKey of N-methyl-5-(2-phenylethoxymethyl)pyridin-2-amine?
The InChIKey is QJPVXGXMCSPFRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-16-15-8-7-14(11-17-15)12-18-10-9-13-5-3-2-4-6-13/h2-8,11H,9-10,12H2,1H3,(H,16,17).
What are the key properties of N-methyl-5-(2-phenylethoxymethyl)pyridin-2-amine?
N-methyl-5-(2-phenylethoxymethyl)pyridin-2-amine has a molecular weight of 242.32 g/mol, XLogP of 2.88, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-(2-phenylethoxymethyl)pyridin-2-amine is sourced from PubChem (CID 114996967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).