2-methoxy-N-methyl-N-propylaniline

C11H17NO — CID 23198488

IUPAC2-methoxy-N-methyl-N-propylaniline
SMILESCCCN(C)c1ccccc1OC
InChIInChI=1S/C11H17NO/c1-4-9-12(2)10-7-5-6-8-11(10)13-3/h5-8H,4,9H2,1-3H3
InChIKeyXINHXSPACMBQPB-UHFFFAOYSA-N
MW179.26 g/mol
LogP2.54
Rot. Bonds4

About 2-methoxy-N-methyl-N-propylaniline

2-methoxy-N-methyl-N-propylaniline (PubChem CID 23198488) has the molecular formula C11H17NO and a molecular weight of 179.26 g/mol. Its IUPAC name is 2-methoxy-N-methyl-N-propylaniline.

Molecular Properties

Compound Name2-methoxy-N-methyl-N-propylaniline
PubChem CID23198488
Molecular FormulaC11H17NO
Molecular Weight179.26 g/mol
Exact Mass179.13
IUPAC Name2-methoxy-N-methyl-N-propylaniline
SMILESCCCN(C)c1ccccc1OC
InChIInChI=1S/C11H17NO/c1-4-9-12(2)10-7-5-6-8-11(10)13-3/h5-8H,4,9H2,1-3H3
InChIKeyXINHXSPACMBQPB-UHFFFAOYSA-N
XLogP2.54
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.26
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(hydrazinylmethyl)-2-methoxy-N-methylaniline
CID 115260697
2-N-butyl-1-N,2-N-dimethyl-1-N-propylbenzene-1,2-diamine
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N,2-dimethyl-N-propylaniline
CID 69435269
2-(ethylamino)-4-(2-methoxy-N-methylanilino)-2-methylbutan-1-ol
CID 64791522
N'-(2-methoxyphenyl)-N'-methyl-N-(4-methylcyclohexyl)ethane-1,2-diamine
CID 62555730
N-[2-(bromomethyl)pentyl]-2-methoxy-N-methylaniline
CID 65012537
4-(2-methoxy-N-methylanilino)-2,2-dimethylbutanoic acid
CID 65247680
N'-(2-methoxyphenyl)-N'-methyl-N-(4-methylphenyl)ethane-1,2-diamine
CID 62553756
2-methoxy-N,N-di(pentadecyl)aniline
CID 139723453
N,N-dihexyl-2-methoxyaniline
CID 59373144
5-isothiocyanato-2-methoxy-N-methyl-N-propylaniline
CID 59167888
N-[2-(1,3-dioxan-2-yl)ethyl]-2-methoxy-N-methylaniline
CID 66472307

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-methyl-N-propylaniline?
The IUPAC name of 2-methoxy-N-methyl-N-propylaniline (CID 23198488) is 2-methoxy-N-methyl-N-propylaniline.
What is the SMILES notation for 2-methoxy-N-methyl-N-propylaniline?
The canonical SMILES for 2-methoxy-N-methyl-N-propylaniline is CCCN(C)c1ccccc1OC.
What is the InChIKey of 2-methoxy-N-methyl-N-propylaniline?
The InChIKey is XINHXSPACMBQPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO/c1-4-9-12(2)10-7-5-6-8-11(10)13-3/h5-8H,4,9H2,1-3H3.
What are the key properties of 2-methoxy-N-methyl-N-propylaniline?
2-methoxy-N-methyl-N-propylaniline has a molecular weight of 179.26 g/mol, XLogP of 2.54, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-methyl-N-propylaniline is sourced from PubChem (CID 23198488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).