2-cyclopropyl-1-(2,5-dimethylphenyl)-2-methoxyethanamine

C14H21NO — CID 116721972

IUPAC2-cyclopropyl-1-(2,5-dimethylphenyl)-2-methoxyethanamine
SMILESCOC(C1CC1)C(N)c1cc(C)ccc1C
InChIInChI=1S/C14H21NO/c1-9-4-5-10(2)12(8-9)13(15)14(16-3)11-6-7-11/h4-5,8,11,13-14H,6-7,15H2,1-3H3
InChIKeyIMGCBCYLLJNGQD-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.73
Rot. Bonds4

About 2-cyclopropyl-1-(2,5-dimethylphenyl)-2-methoxyethanamine

2-cyclopropyl-1-(2,5-dimethylphenyl)-2-methoxyethanamine (PubChem CID 116721972) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 2-cyclopropyl-1-(2,5-dimethylphenyl)-2-methoxyethanamine.

Molecular Properties

Compound Name2-cyclopropyl-1-(2,5-dimethylphenyl)-2-methoxyethanamine
PubChem CID116721972
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name2-cyclopropyl-1-(2,5-dimethylphenyl)-2-methoxyethanamine
SMILESCOC(C1CC1)C(N)c1cc(C)ccc1C
InChIInChI=1S/C14H21NO/c1-9-4-5-10(2)12(8-9)13(15)14(16-3)11-6-7-11/h4-5,8,11,13-14H,6-7,15H2,1-3H3
InChIKeyIMGCBCYLLJNGQD-UHFFFAOYSA-N
XLogP2.73
TPSA35.25 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 ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclopropyl-1-(2,5-dimethylphenyl)propan-1-amine
CID 83154374
1-(2,5-dimethylphenyl)-2-methoxybutan-1-amine
CID 116715174
2-cyclopropyl-1-(2-methoxy-5-methylphenyl)propan-1-amine
CID 83155175
2-cyclopropyl-1-(2,5-dimethylphenyl)-2-ethoxyethanol
CID 116712968
1-cyclopropyl-3-(2,5-dimethylphenyl)-1-methoxypropan-2-ol
CID 116712602
bromo-(2,5-dimethylphenyl)methanamine
CID 116947555
(2,5-dimethylphenyl)-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanamine
CID 112680940
(2,5-dimethylphenyl)-(3-ethylcyclopentyl)methanamine
CID 65410620
1-(2,5-dimethylphenyl)ethanamine
CID 4991344
2-[amino(cyclopropyl)methyl]-4-methylaniline
CID 55282362
[2-cyclopropyl-2-methoxy-1-(2-methylphenyl)ethyl]hydrazine
CID 105272618
2-cyclopropyl-2-(2,5-dimethylphenyl)acetic acid
CID 82024066

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-1-(2,5-dimethylphenyl)-2-methoxyethanamine?
The IUPAC name of 2-cyclopropyl-1-(2,5-dimethylphenyl)-2-methoxyethanamine (CID 116721972) is 2-cyclopropyl-1-(2,5-dimethylphenyl)-2-methoxyethanamine.
What is the SMILES notation for 2-cyclopropyl-1-(2,5-dimethylphenyl)-2-methoxyethanamine?
The canonical SMILES for 2-cyclopropyl-1-(2,5-dimethylphenyl)-2-methoxyethanamine is COC(C1CC1)C(N)c1cc(C)ccc1C.
What is the InChIKey of 2-cyclopropyl-1-(2,5-dimethylphenyl)-2-methoxyethanamine?
The InChIKey is IMGCBCYLLJNGQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-9-4-5-10(2)12(8-9)13(15)14(16-3)11-6-7-11/h4-5,8,11,13-14H,6-7,15H2,1-3H3.
What are the key properties of 2-cyclopropyl-1-(2,5-dimethylphenyl)-2-methoxyethanamine?
2-cyclopropyl-1-(2,5-dimethylphenyl)-2-methoxyethanamine has a molecular weight of 219.33 g/mol, XLogP of 2.73, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-1-(2,5-dimethylphenyl)-2-methoxyethanamine is sourced from PubChem (CID 116721972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).