2-methoxy-5-[2-(methylamino)propyl]aniline

C11H18N2O — CID 82257468

IUPAC2-methoxy-5-[2-(methylamino)propyl]aniline
SMILESCNC(C)Cc1ccc(OC)c(N)c1
InChIInChI=1S/C11H18N2O/c1-8(13-2)6-9-4-5-11(14-3)10(12)7-9/h4-5,7-8,13H,6,12H2,1-3H3
InChIKeyAPZGCFJYUBOMGS-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.43
Rot. Bonds4

About 2-methoxy-5-[2-(methylamino)propyl]aniline

2-methoxy-5-[2-(methylamino)propyl]aniline (PubChem CID 82257468) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is 2-methoxy-5-[2-(methylamino)propyl]aniline.

Molecular Properties

Compound Name2-methoxy-5-[2-(methylamino)propyl]aniline
PubChem CID82257468
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name2-methoxy-5-[2-(methylamino)propyl]aniline
SMILESCNC(C)Cc1ccc(OC)c(N)c1
InChIInChI=1S/C11H18N2O/c1-8(13-2)6-9-4-5-11(14-3)10(12)7-9/h4-5,7-8,13H,6,12H2,1-3H3
InChIKeyAPZGCFJYUBOMGS-UHFFFAOYSA-N
XLogP1.43
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-methoxy-5-[2-(2-methylpropylamino)propyl]aniline
CID 82257431
1-[1-(3-amino-4-methoxyphenyl)propan-2-ylamino]propan-2-ol
CID 82257433
2-methoxy-5-[2-(2-methoxyethylamino)propyl]aniline
CID 82257458
2-methoxy-5-[2-(prop-2-enylamino)propyl]aniline
CID 82257442
1-(4-methoxy-3-methylphenyl)-N-methylpropan-2-amine;hydrobromide
CID 21150467
2-methoxy-5-[2-[(4-methylphenyl)methylamino]propyl]aniline
CID 82257453
2-methoxy-5-[2-[(4-methoxyphenyl)methylamino]propyl]aniline
CID 82257451
N-[1-(3-amino-4-methoxyphenyl)propan-2-yl]cyclooctanamine
CID 82257445
1-(4-fluoro-3-methoxyphenyl)-N-methylpropan-2-amine
CID 69036284
1-(3-ethenyl-4-methoxyphenyl)-N-methylpropan-2-amine
CID 168924254
2-methoxy-5-[2-(2-morpholin-4-ylethylamino)propyl]aniline
CID 82257448
5-(fluoromethyl)-2-methoxyaniline
CID 84650155

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-5-[2-(methylamino)propyl]aniline?
The IUPAC name of 2-methoxy-5-[2-(methylamino)propyl]aniline (CID 82257468) is 2-methoxy-5-[2-(methylamino)propyl]aniline.
What is the SMILES notation for 2-methoxy-5-[2-(methylamino)propyl]aniline?
The canonical SMILES for 2-methoxy-5-[2-(methylamino)propyl]aniline is CNC(C)Cc1ccc(OC)c(N)c1.
What is the InChIKey of 2-methoxy-5-[2-(methylamino)propyl]aniline?
The InChIKey is APZGCFJYUBOMGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-8(13-2)6-9-4-5-11(14-3)10(12)7-9/h4-5,7-8,13H,6,12H2,1-3H3.
What are the key properties of 2-methoxy-5-[2-(methylamino)propyl]aniline?
2-methoxy-5-[2-(methylamino)propyl]aniline has a molecular weight of 194.28 g/mol, XLogP of 1.43, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-5-[2-(methylamino)propyl]aniline is sourced from PubChem (CID 82257468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).