3-[2-methoxy-2-phenyl-1-(propylamino)ethyl]pyridin-4-amine

C17H23N3O — CID 116773275

IUPAC3-[2-methoxy-2-phenyl-1-(propylamino)ethyl]pyridin-4-amine
SMILESCCCNC(c1cnccc1N)C(OC)c1ccccc1
InChIInChI=1S/C17H23N3O/c1-3-10-20-16(14-12-19-11-9-15(14)18)17(21-2)13-7-5-4-6-8-13/h4-9,11-12,16-17,20H,3,10H2,1-2H3,(H2,18,19)
InChIKeyAXMRQJFFZXDBRM-UHFFFAOYSA-N
MW285.39 g/mol
LogP3.09
Rot. Bonds7

About 3-[2-methoxy-2-phenyl-1-(propylamino)ethyl]pyridin-4-amine

3-[2-methoxy-2-phenyl-1-(propylamino)ethyl]pyridin-4-amine (PubChem CID 116773275) has the molecular formula C17H23N3O and a molecular weight of 285.39 g/mol. Its IUPAC name is 3-[2-methoxy-2-phenyl-1-(propylamino)ethyl]pyridin-4-amine.

Molecular Properties

Compound Name3-[2-methoxy-2-phenyl-1-(propylamino)ethyl]pyridin-4-amine
PubChem CID116773275
Molecular FormulaC17H23N3O
Molecular Weight285.39 g/mol
Exact Mass285.18
IUPAC Name3-[2-methoxy-2-phenyl-1-(propylamino)ethyl]pyridin-4-amine
SMILESCCCNC(c1cnccc1N)C(OC)c1ccccc1
InChIInChI=1S/C17H23N3O/c1-3-10-20-16(14-12-19-11-9-15(14)18)17(21-2)13-7-5-4-6-8-13/h4-9,11-12,16-17,20H,3,10H2,1-2H3,(H2,18,19)
InChIKeyAXMRQJFFZXDBRM-UHFFFAOYSA-N
XLogP3.09
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 53.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-[2-methoxy-2-phenyl-1-(propylamino)ethyl]pyridin-4-amine 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

N-ethyl-2-methoxy-1-(4-methyl-3-pyridinyl)-2-phenylethanamine
CID 116773113
3-[3-methoxy-1-(propylamino)butyl]pyridin-4-amine
CID 113391490
3-[(4-methyl-3-pyridinyl)-(propylamino)methyl]pyridin-4-amine
CID 114878589
N-(2-ethoxy-2-phenyl-1-pyridin-3-ylethyl)propan-1-amine
CID 116773849
1-methoxy-1-phenyl-N-propylpropan-2-amine
CID 116773234
3-(4-amino-3-pyridinyl)-1-methoxy-1-phenylpropan-2-ol
CID 116756787
3-[(1-methylpyrazol-4-yl)-(propylamino)methyl]pyridin-4-amine
CID 65200715
N-[phenyl-[4-(trifluoromethyl)-3-pyridinyl]methyl]propan-1-amine
CID 102708017
3-[3-ethoxy-1-(propylamino)propyl]pyridin-4-amine
CID 106815087
N-[1-(5-chlorothiophen-2-yl)-2-methoxy-2-phenylethyl]propan-1-amine
CID 116773278
3-[(3-bromo-4-methoxyphenyl)-(propylamino)methyl]pyridin-4-amine
CID 106950927
3-[(1-methoxycyclohexyl)-(propylamino)methyl]pyridin-4-amine
CID 116763449

Frequently Asked Questions

What is the IUPAC name of 3-[2-methoxy-2-phenyl-1-(propylamino)ethyl]pyridin-4-amine?
The IUPAC name of 3-[2-methoxy-2-phenyl-1-(propylamino)ethyl]pyridin-4-amine (CID 116773275) is 3-[2-methoxy-2-phenyl-1-(propylamino)ethyl]pyridin-4-amine.
What is the SMILES notation for 3-[2-methoxy-2-phenyl-1-(propylamino)ethyl]pyridin-4-amine?
The canonical SMILES for 3-[2-methoxy-2-phenyl-1-(propylamino)ethyl]pyridin-4-amine is CCCNC(c1cnccc1N)C(OC)c1ccccc1.
What is the InChIKey of 3-[2-methoxy-2-phenyl-1-(propylamino)ethyl]pyridin-4-amine?
The InChIKey is AXMRQJFFZXDBRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O/c1-3-10-20-16(14-12-19-11-9-15(14)18)17(21-2)13-7-5-4-6-8-13/h4-9,11-12,16-17,20H,3,10H2,1-2H3,(H2,18,19).
What are the key properties of 3-[2-methoxy-2-phenyl-1-(propylamino)ethyl]pyridin-4-amine?
3-[2-methoxy-2-phenyl-1-(propylamino)ethyl]pyridin-4-amine has a molecular weight of 285.39 g/mol, XLogP of 3.09, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-methoxy-2-phenyl-1-(propylamino)ethyl]pyridin-4-amine is sourced from PubChem (CID 116773275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).