N-[[6-methyl-3-(2-phenylethoxy)-2-pyridinyl]methyl]propan-2-amine

C18H24N2O — CID 79158258

IUPACN-[[6-methyl-3-(2-phenylethoxy)-2-pyridinyl]methyl]propan-2-amine
SMILESCc1ccc(OCCc2ccccc2)c(CNC(C)C)n1
InChIInChI=1S/C18H24N2O/c1-14(2)19-13-17-18(10-9-15(3)20-17)21-12-11-16-7-5-4-6-8-16/h4-10,14,19H,11-13H2,1-3H3
InChIKeyPPPHKZIFZYWRER-UHFFFAOYSA-N
MW284.40 g/mol
LogP3.51
Rot. Bonds7

About N-[[6-methyl-3-(2-phenylethoxy)-2-pyridinyl]methyl]propan-2-amine

N-[[6-methyl-3-(2-phenylethoxy)-2-pyridinyl]methyl]propan-2-amine (PubChem CID 79158258) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is N-[[6-methyl-3-(2-phenylethoxy)-2-pyridinyl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[6-methyl-3-(2-phenylethoxy)-2-pyridinyl]methyl]propan-2-amine
PubChem CID79158258
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC NameN-[[6-methyl-3-(2-phenylethoxy)-2-pyridinyl]methyl]propan-2-amine
SMILESCc1ccc(OCCc2ccccc2)c(CNC(C)C)n1
InChIInChI=1S/C18H24N2O/c1-14(2)19-13-17-18(10-9-15(3)20-17)21-12-11-16-7-5-4-6-8-16/h4-10,14,19H,11-13H2,1-3H3
InChIKeyPPPHKZIFZYWRER-UHFFFAOYSA-N
XLogP3.51
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[[6-methyl-3-(2-phenylethoxy)-2-pyridinyl]methyl]propan-2-amine with MolForge

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Related Compounds

N-[[6-methyl-3-(3-phenylpropoxy)-2-pyridinyl]methyl]ethanamine
CID 79157323
5-[[6-methyl-2-[(propan-2-ylamino)methyl]-3-pyridinyl]oxy]pentanenitrile
CID 79151307
N-[(6-methyl-3-pent-4-ynoxy-2-pyridinyl)methyl]propan-2-amine
CID 113374142
methyl 3-[[6-methyl-2-[(propan-2-ylamino)methyl]-3-pyridinyl]oxy]propanoate
CID 79151614
3-[[6-methyl-2-[(propan-2-ylamino)methyl]-3-pyridinyl]oxy]propanamide
CID 79151234
N-[[6-methyl-3-[(6-methyl-2-pyridinyl)methoxy]-2-pyridinyl]methyl]propan-2-amine
CID 79262670
3-[[6-methyl-2-[(propan-2-ylamino)methyl]-3-pyridinyl]oxy]-N-propan-2-ylpropanamide
CID 79158097
N-[[6-methyl-3-(thiophen-2-ylmethoxy)-2-pyridinyl]methyl]propan-2-amine
CID 79151007
N-[(3-butan-2-yloxy-6-methyl-2-pyridinyl)methyl]propan-2-amine
CID 79150768
N-[[6-methyl-3-(oxan-4-ylmethoxy)-2-pyridinyl]methyl]propan-2-amine
CID 79151236
N-[[6-methyl-3-[(3-methyl-1,2-oxazol-5-yl)methoxy]-2-pyridinyl]methyl]propan-2-amine
CID 79150848
N-methyl-1-[6-methyl-3-(2-pyridin-2-ylethoxy)-2-pyridinyl]methanamine
CID 79151107

Frequently Asked Questions

What is the IUPAC name of N-[[6-methyl-3-(2-phenylethoxy)-2-pyridinyl]methyl]propan-2-amine?
The IUPAC name of N-[[6-methyl-3-(2-phenylethoxy)-2-pyridinyl]methyl]propan-2-amine (CID 79158258) is N-[[6-methyl-3-(2-phenylethoxy)-2-pyridinyl]methyl]propan-2-amine.
What is the SMILES notation for N-[[6-methyl-3-(2-phenylethoxy)-2-pyridinyl]methyl]propan-2-amine?
The canonical SMILES for N-[[6-methyl-3-(2-phenylethoxy)-2-pyridinyl]methyl]propan-2-amine is Cc1ccc(OCCc2ccccc2)c(CNC(C)C)n1.
What is the InChIKey of N-[[6-methyl-3-(2-phenylethoxy)-2-pyridinyl]methyl]propan-2-amine?
The InChIKey is PPPHKZIFZYWRER-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-14(2)19-13-17-18(10-9-15(3)20-17)21-12-11-16-7-5-4-6-8-16/h4-10,14,19H,11-13H2,1-3H3.
What are the key properties of N-[[6-methyl-3-(2-phenylethoxy)-2-pyridinyl]methyl]propan-2-amine?
N-[[6-methyl-3-(2-phenylethoxy)-2-pyridinyl]methyl]propan-2-amine has a molecular weight of 284.40 g/mol, XLogP of 3.51, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-methyl-3-(2-phenylethoxy)-2-pyridinyl]methyl]propan-2-amine is sourced from PubChem (CID 79158258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).