1-[4-(2-methoxyethyl)phenyl]-N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine

C18H29NO — CID 66476868

IUPAC1-[4-(2-methoxyethyl)phenyl]-N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine
SMILESCNC(c1ccc(CCOC)cc1)C1C(C)(C)C1(C)C
InChIInChI=1S/C18H29NO/c1-17(2)16(18(17,3)4)15(19-5)14-9-7-13(8-10-14)11-12-20-6/h7-10,15-16,19H,11-12H2,1-6H3
InChIKeyOALKRNZUOGEELA-UHFFFAOYSA-N
MW275.44 g/mol
LogP3.82
Rot. Bonds6

About 1-[4-(2-methoxyethyl)phenyl]-N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine

1-[4-(2-methoxyethyl)phenyl]-N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine (PubChem CID 66476868) has the molecular formula C18H29NO and a molecular weight of 275.44 g/mol. Its IUPAC name is 1-[4-(2-methoxyethyl)phenyl]-N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine.

Molecular Properties

Compound Name1-[4-(2-methoxyethyl)phenyl]-N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine
PubChem CID66476868
Molecular FormulaC18H29NO
Molecular Weight275.44 g/mol
Exact Mass275.22
IUPAC Name1-[4-(2-methoxyethyl)phenyl]-N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine
SMILESCNC(c1ccc(CCOC)cc1)C1C(C)(C)C1(C)C
InChIInChI=1S/C18H29NO/c1-17(2)16(18(17,3)4)15(19-5)14-9-7-13(8-10-14)11-12-20-6/h7-10,15-16,19H,11-12H2,1-6H3
InChIKeyOALKRNZUOGEELA-UHFFFAOYSA-N
XLogP3.82
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.44
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclopropyl-1-[4-(2-methoxyethyl)phenyl]-N-methylmethanamine
CID 43482389
1-(4-ethylphenyl)-N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine
CID 66478211
N-[cyclopropyl-[4-(2-methoxyethyl)phenyl]methyl]ethanamine
CID 43489767
1-[4-(2-methoxyethyl)phenyl]-N,4-dimethylpentan-1-amine
CID 43482360
1-[4-(2-methoxyethyl)phenyl]-N-methylnonan-1-amine
CID 65450078
2,2,3,3,3-pentafluoro-1-[4-(2-methoxyethyl)phenyl]-N-methylpropan-1-amine
CID 43482337
1-(4-methoxy-3-methylphenyl)-N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine
CID 66476681
1-(2-methoxyethyl)-4-(2-methylpropyl)benzene
CID 67638248
N-[cyclopentyl-[4-(2-methoxyethyl)phenyl]methyl]propan-1-amine
CID 43495393
1-[4-(2-methoxyethyl)phenyl]-1-(3-methoxythiophen-2-yl)-N-methylmethanamine
CID 81127265
1-[4-(2-methoxyethyl)phenyl]-1-(2-methoxyphenyl)-N-methylmethanamine
CID 43482394
1-[chloro(cyclopropyl)methyl]-4-(2-methoxyethyl)benzene
CID 61084514

Frequently Asked Questions

What is the IUPAC name of 1-[4-(2-methoxyethyl)phenyl]-N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine?
The IUPAC name of 1-[4-(2-methoxyethyl)phenyl]-N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine (CID 66476868) is 1-[4-(2-methoxyethyl)phenyl]-N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine.
What is the SMILES notation for 1-[4-(2-methoxyethyl)phenyl]-N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine?
The canonical SMILES for 1-[4-(2-methoxyethyl)phenyl]-N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine is CNC(c1ccc(CCOC)cc1)C1C(C)(C)C1(C)C.
What is the InChIKey of 1-[4-(2-methoxyethyl)phenyl]-N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine?
The InChIKey is OALKRNZUOGEELA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29NO/c1-17(2)16(18(17,3)4)15(19-5)14-9-7-13(8-10-14)11-12-20-6/h7-10,15-16,19H,11-12H2,1-6H3.
What are the key properties of 1-[4-(2-methoxyethyl)phenyl]-N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine?
1-[4-(2-methoxyethyl)phenyl]-N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine has a molecular weight of 275.44 g/mol, XLogP of 3.82, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(2-methoxyethyl)phenyl]-N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine is sourced from PubChem (CID 66476868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).