1-(1-cyclohexyl-4,4-dimethylpiperidin-3-yl)-N-methylmethanamine

C15H30N2 — CID 117025891

IUPAC1-(1-cyclohexyl-4,4-dimethylpiperidin-3-yl)-N-methylmethanamine
SMILESCNCC1CN(C2CCCCC2)CCC1(C)C
InChIInChI=1S/C15H30N2/c1-15(2)9-10-17(12-13(15)11-16-3)14-7-5-4-6-8-14/h13-14,16H,4-12H2,1-3H3
InChIKeyCVZPSBCOLDYRAG-UHFFFAOYSA-N
MW238.42 g/mol
LogP2.89
Rot. Bonds3

About 1-(1-cyclohexyl-4,4-dimethylpiperidin-3-yl)-N-methylmethanamine

1-(1-cyclohexyl-4,4-dimethylpiperidin-3-yl)-N-methylmethanamine (PubChem CID 117025891) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is 1-(1-cyclohexyl-4,4-dimethylpiperidin-3-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(1-cyclohexyl-4,4-dimethylpiperidin-3-yl)-N-methylmethanamine
PubChem CID117025891
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC Name1-(1-cyclohexyl-4,4-dimethylpiperidin-3-yl)-N-methylmethanamine
SMILESCNCC1CN(C2CCCCC2)CCC1(C)C
InChIInChI=1S/C15H30N2/c1-15(2)9-10-17(12-13(15)11-16-3)14-7-5-4-6-8-14/h13-14,16H,4-12H2,1-3H3
InChIKeyCVZPSBCOLDYRAG-UHFFFAOYSA-N
XLogP2.89
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(1-cyclohexyl-4,4-dimethylpiperidin-3-yl)-N-methylmethanamine?
The IUPAC name of 1-(1-cyclohexyl-4,4-dimethylpiperidin-3-yl)-N-methylmethanamine (CID 117025891) is 1-(1-cyclohexyl-4,4-dimethylpiperidin-3-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(1-cyclohexyl-4,4-dimethylpiperidin-3-yl)-N-methylmethanamine?
The canonical SMILES for 1-(1-cyclohexyl-4,4-dimethylpiperidin-3-yl)-N-methylmethanamine is CNCC1CN(C2CCCCC2)CCC1(C)C.
What is the InChIKey of 1-(1-cyclohexyl-4,4-dimethylpiperidin-3-yl)-N-methylmethanamine?
The InChIKey is CVZPSBCOLDYRAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-15(2)9-10-17(12-13(15)11-16-3)14-7-5-4-6-8-14/h13-14,16H,4-12H2,1-3H3.
What are the key properties of 1-(1-cyclohexyl-4,4-dimethylpiperidin-3-yl)-N-methylmethanamine?
1-(1-cyclohexyl-4,4-dimethylpiperidin-3-yl)-N-methylmethanamine has a molecular weight of 238.42 g/mol, XLogP of 2.89, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-cyclohexyl-4,4-dimethylpiperidin-3-yl)-N-methylmethanamine is sourced from PubChem (CID 117025891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).