1-cyclopropyl-1-(2-methoxy-4,6-dimethylphenyl)-N-methylmethanamine

C14H21NO — CID 106680447

IUPAC1-cyclopropyl-1-(2-methoxy-4,6-dimethylphenyl)-N-methylmethanamine
SMILESCNC(c1c(C)cc(C)cc1OC)C1CC1
InChIInChI=1S/C14H21NO/c1-9-7-10(2)13(12(8-9)16-4)14(15-3)11-5-6-11/h7-8,11,14-15H,5-6H2,1-4H3
InChIKeyMJBGFXFTGNHUHW-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.98
Rot. Bonds4

About 1-cyclopropyl-1-(2-methoxy-4,6-dimethylphenyl)-N-methylmethanamine

1-cyclopropyl-1-(2-methoxy-4,6-dimethylphenyl)-N-methylmethanamine (PubChem CID 106680447) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 1-cyclopropyl-1-(2-methoxy-4,6-dimethylphenyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-cyclopropyl-1-(2-methoxy-4,6-dimethylphenyl)-N-methylmethanamine
PubChem CID106680447
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name1-cyclopropyl-1-(2-methoxy-4,6-dimethylphenyl)-N-methylmethanamine
SMILESCNC(c1c(C)cc(C)cc1OC)C1CC1
InChIInChI=1S/C14H21NO/c1-9-7-10(2)13(12(8-9)16-4)14(15-3)11-5-6-11/h7-8,11,14-15H,5-6H2,1-4H3
InChIKeyMJBGFXFTGNHUHW-UHFFFAOYSA-N
XLogP2.98
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[cyclopentyl-(2-methoxy-4,6-dimethylphenyl)methyl]hydrazine
CID 106682698
1-cyclopropyl-N-methyl-1-(2,4,6-trimethoxyphenyl)methanamine
CID 43483009
1-(2-methoxy-4,6-dimethylphenyl)-N-methyl-1-(oxan-2-yl)methanamine
CID 106682477
1-cyclobutyl-N-methyl-1-(2,4,6-trimethylphenyl)methanamine
CID 43484275
4-[methylamino-(2,4,6-trimethylphenyl)methyl]cyclohexan-1-ol
CID 116957010
N-[cycloheptyl-(2-methoxy-4,6-dimethylphenyl)methyl]ethanamine
CID 106680669
(1R)-1-(2-methoxy-4,6-dimethylphenyl)-N-methylethanamine
CID 96670588
1-(2-methoxy-4,6-dimethylphenyl)-N-methyl-1-morpholin-2-ylmethanamine
CID 116956467
cyclobutyl-(2-methoxy-4,6-dimethylphenyl)methanamine
CID 82493927
cyclopentyl-(2-methoxy-4,6-dimethylphenyl)methanol
CID 106679603
1-cyclopropyl-1-(4-fluoro-2,6-dimethylphenyl)-N-methylmethanamine
CID 106877639
2-(2-methoxy-4,6-dimethylphenyl)-2-(methylamino)acetonitrile
CID 116955039

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-1-(2-methoxy-4,6-dimethylphenyl)-N-methylmethanamine?
The IUPAC name of 1-cyclopropyl-1-(2-methoxy-4,6-dimethylphenyl)-N-methylmethanamine (CID 106680447) is 1-cyclopropyl-1-(2-methoxy-4,6-dimethylphenyl)-N-methylmethanamine.
What is the SMILES notation for 1-cyclopropyl-1-(2-methoxy-4,6-dimethylphenyl)-N-methylmethanamine?
The canonical SMILES for 1-cyclopropyl-1-(2-methoxy-4,6-dimethylphenyl)-N-methylmethanamine is CNC(c1c(C)cc(C)cc1OC)C1CC1.
What is the InChIKey of 1-cyclopropyl-1-(2-methoxy-4,6-dimethylphenyl)-N-methylmethanamine?
The InChIKey is MJBGFXFTGNHUHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-9-7-10(2)13(12(8-9)16-4)14(15-3)11-5-6-11/h7-8,11,14-15H,5-6H2,1-4H3.
What are the key properties of 1-cyclopropyl-1-(2-methoxy-4,6-dimethylphenyl)-N-methylmethanamine?
1-cyclopropyl-1-(2-methoxy-4,6-dimethylphenyl)-N-methylmethanamine has a molecular weight of 219.33 g/mol, XLogP of 2.98, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-1-(2-methoxy-4,6-dimethylphenyl)-N-methylmethanamine is sourced from PubChem (CID 106680447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).