4-methoxy-N-(3-methoxypropyl)aniline

C11H17NO2 — CID 60925973

IUPAC4-methoxy-N-(3-methoxypropyl)aniline
SMILESCOCCCNc1ccc(OC)cc1
InChIInChI=1S/C11H17NO2/c1-13-9-3-8-12-10-4-6-11(14-2)7-5-10/h4-7,12H,3,8-9H2,1-2H3
InChIKeyJWXOPHABWRQUOL-UHFFFAOYSA-N
MW195.26 g/mol
LogP2.14
Rot. Bonds6

About 4-methoxy-N-(3-methoxypropyl)aniline

4-methoxy-N-(3-methoxypropyl)aniline (PubChem CID 60925973) has the molecular formula C11H17NO2 and a molecular weight of 195.26 g/mol. Its IUPAC name is 4-methoxy-N-(3-methoxypropyl)aniline.

Molecular Properties

Compound Name4-methoxy-N-(3-methoxypropyl)aniline
PubChem CID60925973
Molecular FormulaC11H17NO2
Molecular Weight195.26 g/mol
Exact Mass195.13
IUPAC Name4-methoxy-N-(3-methoxypropyl)aniline
SMILESCOCCCNc1ccc(OC)cc1
InChIInChI=1S/C11H17NO2/c1-13-9-3-8-12-10-4-6-11(14-2)7-5-10/h4-7,12H,3,8-9H2,1-2H3
InChIKeyJWXOPHABWRQUOL-UHFFFAOYSA-N
XLogP2.14
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.26
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N'-(4-methoxyphenyl)-N-(3-methoxypropyl)ethane-1,2-diamine
CID 54805853
4-methoxy-N-[3-[6-[3-(4-methoxyanilino)propoxy]naphthalen-2-yl]oxypropyl]aniline
CID 10096933
N-(3-methoxypropyl)-4-(trifluoromethoxy)aniline
CID 54935363
4-methoxy-N-(2-phenoxyethyl)aniline
CID 39347663
4-methoxy-N-(4-methylsulfanylbutyl)aniline
CID 103087220
4-iodo-N-[2-(4-methoxyphenoxy)ethyl]aniline
CID 60679168
4-[2-(4-methoxyanilino)ethoxy]phenol
CID 71735773
N-(4-dimethoxysilylbutyl)-4-methoxyaniline
CID 173092192
N-(4-chloro-4,4-difluorobutyl)-4-methoxyaniline
CID 67832517
N-(4-methoxybutyl)aniline
CID 13042774
5-N-(4-methoxyphenyl)-3-N-(3-methoxypropyl)-1,2,4-triazine-3,5-diamine
CID 112943964
4-(6-methoxyhexylamino)phenol
CID 162494970

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-(3-methoxypropyl)aniline?
The IUPAC name of 4-methoxy-N-(3-methoxypropyl)aniline (CID 60925973) is 4-methoxy-N-(3-methoxypropyl)aniline.
What is the SMILES notation for 4-methoxy-N-(3-methoxypropyl)aniline?
The canonical SMILES for 4-methoxy-N-(3-methoxypropyl)aniline is COCCCNc1ccc(OC)cc1.
What is the InChIKey of 4-methoxy-N-(3-methoxypropyl)aniline?
The InChIKey is JWXOPHABWRQUOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO2/c1-13-9-3-8-12-10-4-6-11(14-2)7-5-10/h4-7,12H,3,8-9H2,1-2H3.
What are the key properties of 4-methoxy-N-(3-methoxypropyl)aniline?
4-methoxy-N-(3-methoxypropyl)aniline has a molecular weight of 195.26 g/mol, XLogP of 2.14, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-(3-methoxypropyl)aniline is sourced from PubChem (CID 60925973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).