1-cycloheptyl-1-(3-methoxy-4-pyridinyl)-N-methylmethanamine

C15H24N2O — CID 105065977

IUPAC1-cycloheptyl-1-(3-methoxy-4-pyridinyl)-N-methylmethanamine
SMILESCNC(c1ccncc1OC)C1CCCCCC1
InChIInChI=1S/C15H24N2O/c1-16-15(12-7-5-3-4-6-8-12)13-9-10-17-11-14(13)18-2/h9-12,15-16H,3-8H2,1-2H3
InChIKeyVALIVUTXLAVPJU-UHFFFAOYSA-N
MW248.37 g/mol
LogP3.32
Rot. Bonds4

About 1-cycloheptyl-1-(3-methoxy-4-pyridinyl)-N-methylmethanamine

1-cycloheptyl-1-(3-methoxy-4-pyridinyl)-N-methylmethanamine (PubChem CID 105065977) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 1-cycloheptyl-1-(3-methoxy-4-pyridinyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-cycloheptyl-1-(3-methoxy-4-pyridinyl)-N-methylmethanamine
PubChem CID105065977
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name1-cycloheptyl-1-(3-methoxy-4-pyridinyl)-N-methylmethanamine
SMILESCNC(c1ccncc1OC)C1CCCCCC1
InChIInChI=1S/C15H24N2O/c1-16-15(12-7-5-3-4-6-8-12)13-9-10-17-11-14(13)18-2/h9-12,15-16H,3-8H2,1-2H3
InChIKeyVALIVUTXLAVPJU-UHFFFAOYSA-N
XLogP3.32
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclopentyl-1-(3-methoxy-4-pyridinyl)-N-methylmethanamine
CID 105065154
1-cyclobutyl-1-(2-methoxyphenyl)-N-methylmethanamine
CID 64986514
1-(2-bicyclo[2.2.1]heptanyl)-1-(3-methoxy-4-pyridinyl)-N-methylmethanamine
CID 114246814
1-cyclohexyl-N-methyl-1-(2,3,4-trimethoxyphenyl)methanamine
CID 43589052
1-cycloheptyl-1-(2-methoxy-3-pyridinyl)-N-methylmethanamine
CID 105176373
1-cycloheptyl-1-isoquinolin-8-yl-N-methylmethanamine
CID 103136425
1-(3-methoxy-4-pyridinyl)-N-methyl-1-(2-phenylcyclopropyl)methanamine
CID 105066144
1-(3-methoxy-4-pyridinyl)-N-methyl-1-(2,2,5,5-tetramethyloxolan-3-yl)methanamine
CID 105066147
1-(2-bromo-4,5-dimethoxyphenyl)-1-cycloheptyl-N-methylmethanamine
CID 63509267
1-cyclohexyl-N-methyl-1-pyridin-3-ylmethanamine
CID 60817955
[2-cyclobutyl-1-(3-methoxy-4-pyridinyl)ethyl]hydrazine
CID 105310161
1-(2-cyclobutylphenyl)-1-(3-methoxy-4-pyridinyl)-N-methylmethanamine
CID 105066142

Frequently Asked Questions

What is the IUPAC name of 1-cycloheptyl-1-(3-methoxy-4-pyridinyl)-N-methylmethanamine?
The IUPAC name of 1-cycloheptyl-1-(3-methoxy-4-pyridinyl)-N-methylmethanamine (CID 105065977) is 1-cycloheptyl-1-(3-methoxy-4-pyridinyl)-N-methylmethanamine.
What is the SMILES notation for 1-cycloheptyl-1-(3-methoxy-4-pyridinyl)-N-methylmethanamine?
The canonical SMILES for 1-cycloheptyl-1-(3-methoxy-4-pyridinyl)-N-methylmethanamine is CNC(c1ccncc1OC)C1CCCCCC1.
What is the InChIKey of 1-cycloheptyl-1-(3-methoxy-4-pyridinyl)-N-methylmethanamine?
The InChIKey is VALIVUTXLAVPJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-16-15(12-7-5-3-4-6-8-12)13-9-10-17-11-14(13)18-2/h9-12,15-16H,3-8H2,1-2H3.
What are the key properties of 1-cycloheptyl-1-(3-methoxy-4-pyridinyl)-N-methylmethanamine?
1-cycloheptyl-1-(3-methoxy-4-pyridinyl)-N-methylmethanamine has a molecular weight of 248.37 g/mol, XLogP of 3.32, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cycloheptyl-1-(3-methoxy-4-pyridinyl)-N-methylmethanamine is sourced from PubChem (CID 105065977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).