N-(methoxymethyl)-1-(4-methoxy-3-methylphenyl)-N-methylmethanamine

C12H19NO2 — CID 115258645

IUPACN-(methoxymethyl)-1-(4-methoxy-3-methylphenyl)-N-methylmethanamine
SMILESCOCN(C)Cc1ccc(OC)c(C)c1
InChIInChI=1S/C12H19NO2/c1-10-7-11(5-6-12(10)15-4)8-13(2)9-14-3/h5-7H,8-9H2,1-4H3
InChIKeyHEFCZHDPNDXIDT-UHFFFAOYSA-N
MW209.29 g/mol
LogP2.04
Rot. Bonds5

About N-(methoxymethyl)-1-(4-methoxy-3-methylphenyl)-N-methylmethanamine

N-(methoxymethyl)-1-(4-methoxy-3-methylphenyl)-N-methylmethanamine (PubChem CID 115258645) has the molecular formula C12H19NO2 and a molecular weight of 209.29 g/mol. Its IUPAC name is N-(methoxymethyl)-1-(4-methoxy-3-methylphenyl)-N-methylmethanamine.

Molecular Properties

Compound NameN-(methoxymethyl)-1-(4-methoxy-3-methylphenyl)-N-methylmethanamine
PubChem CID115258645
Molecular FormulaC12H19NO2
Molecular Weight209.29 g/mol
Exact Mass209.14
IUPAC NameN-(methoxymethyl)-1-(4-methoxy-3-methylphenyl)-N-methylmethanamine
SMILESCOCN(C)Cc1ccc(OC)c(C)c1
InChIInChI=1S/C12H19NO2/c1-10-7-11(5-6-12(10)15-4)8-13(2)9-14-3/h5-7H,8-9H2,1-4H3
InChIKeyHEFCZHDPNDXIDT-UHFFFAOYSA-N
XLogP2.04
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 52.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

N-(methoxymethyl)-2-(4-methoxy-3-methylphenyl)-N-methylethanamine
CID 115258978
2-[(4-methoxy-3-methylphenyl)methyl-methylamino]ethanol
CID 115216225
1-N-[(4-methoxy-3-methylphenyl)methyl]-1-N,2-dimethylpropane-1,2-diamine
CID 115135992
3-chloro-N-[(4-methoxy-3-methylphenyl)methyl]-N-methylpropan-1-amine
CID 115215695
1-N-[(4-methoxy-3-methylphenyl)methyl]-1-N-methylbutane-1,3-diamine
CID 115199383
2-ethyl-N'-[(4-methoxy-3-methylphenyl)methyl]-N'-methylpropane-1,3-diamine
CID 115251543
N-[[3-(aminomethyl)oxetan-3-yl]methyl]-1-(4-methoxy-3-methylphenyl)-N-methylmethanamine
CID 115249490
2-[(4-methoxy-3-methylphenyl)methyl-methylamino]-2-oxoacetic acid
CID 82129654
1-(3-chloro-4-methoxyphenyl)-N-(chloromethyl)-N-methylmethanamine
CID 115263145
(4-methoxy-3-methylphenyl)methylphosphane
CID 89138390
1-(4-methoxy-3-methylphenyl)-N-methyl-N-[(3-methylpyrrolidin-3-yl)methyl]methanamine;hydrochloride
CID 120899620
N-(1,3-benzoxazol-2-ylmethyl)-1-(4-methoxy-3-methylphenyl)-N-methylmethanamine
CID 60589363

Frequently Asked Questions

What is the IUPAC name of N-(methoxymethyl)-1-(4-methoxy-3-methylphenyl)-N-methylmethanamine?
The IUPAC name of N-(methoxymethyl)-1-(4-methoxy-3-methylphenyl)-N-methylmethanamine (CID 115258645) is N-(methoxymethyl)-1-(4-methoxy-3-methylphenyl)-N-methylmethanamine.
What is the SMILES notation for N-(methoxymethyl)-1-(4-methoxy-3-methylphenyl)-N-methylmethanamine?
The canonical SMILES for N-(methoxymethyl)-1-(4-methoxy-3-methylphenyl)-N-methylmethanamine is COCN(C)Cc1ccc(OC)c(C)c1.
What is the InChIKey of N-(methoxymethyl)-1-(4-methoxy-3-methylphenyl)-N-methylmethanamine?
The InChIKey is HEFCZHDPNDXIDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO2/c1-10-7-11(5-6-12(10)15-4)8-13(2)9-14-3/h5-7H,8-9H2,1-4H3.
What are the key properties of N-(methoxymethyl)-1-(4-methoxy-3-methylphenyl)-N-methylmethanamine?
N-(methoxymethyl)-1-(4-methoxy-3-methylphenyl)-N-methylmethanamine has a molecular weight of 209.29 g/mol, XLogP of 2.04, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(methoxymethyl)-1-(4-methoxy-3-methylphenyl)-N-methylmethanamine is sourced from PubChem (CID 115258645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).