1-(2,2-dimethylcyclopropyl)-1-(3,5-dimethylphenyl)-N-methylmethanamine

C15H23N — CID 107004152

IUPAC1-(2,2-dimethylcyclopropyl)-1-(3,5-dimethylphenyl)-N-methylmethanamine
SMILESCNC(c1cc(C)cc(C)c1)C1CC1(C)C
InChIInChI=1S/C15H23N/c1-10-6-11(2)8-12(7-10)14(16-5)13-9-15(13,3)4/h6-8,13-14,16H,9H2,1-5H3
InChIKeyBJUFWCZDZDFZGI-UHFFFAOYSA-N
MW217.36 g/mol
LogP3.61
Rot. Bonds3

About 1-(2,2-dimethylcyclopropyl)-1-(3,5-dimethylphenyl)-N-methylmethanamine

1-(2,2-dimethylcyclopropyl)-1-(3,5-dimethylphenyl)-N-methylmethanamine (PubChem CID 107004152) has the molecular formula C15H23N and a molecular weight of 217.36 g/mol. Its IUPAC name is 1-(2,2-dimethylcyclopropyl)-1-(3,5-dimethylphenyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(2,2-dimethylcyclopropyl)-1-(3,5-dimethylphenyl)-N-methylmethanamine
PubChem CID107004152
Molecular FormulaC15H23N
Molecular Weight217.36 g/mol
Exact Mass217.18
IUPAC Name1-(2,2-dimethylcyclopropyl)-1-(3,5-dimethylphenyl)-N-methylmethanamine
SMILESCNC(c1cc(C)cc(C)c1)C1CC1(C)C
InChIInChI=1S/C15H23N/c1-10-6-11(2)8-12(7-10)14(16-5)13-9-15(13,3)4/h6-8,13-14,16H,9H2,1-5H3
InChIKeyBJUFWCZDZDFZGI-UHFFFAOYSA-N
XLogP3.61
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.36
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2,2-dimethylcyclopropyl)-1-(2-fluorophenyl)-N-methylmethanamine
CID 107004239
1-(3-bromo-5-methylthiophen-2-yl)-1-(2,2-dimethylcyclopropyl)-N-methylmethanamine
CID 107001273
1-(3,5-dimethylphenyl)-1-(4-ethylcyclohexyl)-N-methylmethanamine
CID 65392502
1-(3,5-dimethylphenyl)-N-methyl-1-(6-oxaspiro[4.5]decan-9-yl)methanamine
CID 105016685
N-[(2,2-dimethylcyclohexyl)-(3,5-dimethylphenyl)methyl]ethanamine
CID 107187850
1-(2,2-dimethylcyclopropyl)-N-methyl-1-(7-methyl-1-benzofuran-2-yl)methanamine
CID 107005057
1-(3-fluoro-5-methylphenyl)-N-methyl-1-(2-methylcyclopropyl)methanamine
CID 79704372
1-cyclobutyl-1-(3-fluoro-5-methylphenyl)-N-methylmethanamine
CID 79705578
[1-(2,2-dimethylcyclopropyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine
CID 107005567
1-(3,5-dimethylphenyl)-N-methyl-1-(4-methylthiomorpholin-3-yl)methanamine
CID 106444784
1-(6-bicyclo[3.1.0]hexanyl)-1-(3-fluoro-5-methylphenyl)-N-methylmethanamine
CID 105016349
1-(2,3-dihydro-1-benzothiophen-2-yl)-1-(3,5-dimethylphenyl)-N-methylmethanamine
CID 105097285

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-dimethylcyclopropyl)-1-(3,5-dimethylphenyl)-N-methylmethanamine?
The IUPAC name of 1-(2,2-dimethylcyclopropyl)-1-(3,5-dimethylphenyl)-N-methylmethanamine (CID 107004152) is 1-(2,2-dimethylcyclopropyl)-1-(3,5-dimethylphenyl)-N-methylmethanamine.
What is the SMILES notation for 1-(2,2-dimethylcyclopropyl)-1-(3,5-dimethylphenyl)-N-methylmethanamine?
The canonical SMILES for 1-(2,2-dimethylcyclopropyl)-1-(3,5-dimethylphenyl)-N-methylmethanamine is CNC(c1cc(C)cc(C)c1)C1CC1(C)C.
What is the InChIKey of 1-(2,2-dimethylcyclopropyl)-1-(3,5-dimethylphenyl)-N-methylmethanamine?
The InChIKey is BJUFWCZDZDFZGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N/c1-10-6-11(2)8-12(7-10)14(16-5)13-9-15(13,3)4/h6-8,13-14,16H,9H2,1-5H3.
What are the key properties of 1-(2,2-dimethylcyclopropyl)-1-(3,5-dimethylphenyl)-N-methylmethanamine?
1-(2,2-dimethylcyclopropyl)-1-(3,5-dimethylphenyl)-N-methylmethanamine has a molecular weight of 217.36 g/mol, XLogP of 3.61, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-dimethylcyclopropyl)-1-(3,5-dimethylphenyl)-N-methylmethanamine is sourced from PubChem (CID 107004152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).