[2,5-dimethyl-1-(2-methylpyrrolidin-1-yl)cyclohexyl]methanamine

C14H28N2 — CID 64760563

IUPAC[2,5-dimethyl-1-(2-methylpyrrolidin-1-yl)cyclohexyl]methanamine
SMILESCC1CCC(C)C(CN)(N2CCCC2C)C1
InChIInChI=1S/C14H28N2/c1-11-6-7-12(2)14(9-11,10-15)16-8-4-5-13(16)3/h11-13H,4-10,15H2,1-3H3
InChIKeyRRNBXVGMDIREJS-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.62
Rot. Bonds2

About [2,5-dimethyl-1-(2-methylpyrrolidin-1-yl)cyclohexyl]methanamine

[2,5-dimethyl-1-(2-methylpyrrolidin-1-yl)cyclohexyl]methanamine (PubChem CID 64760563) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is [2,5-dimethyl-1-(2-methylpyrrolidin-1-yl)cyclohexyl]methanamine.

Molecular Properties

Compound Name[2,5-dimethyl-1-(2-methylpyrrolidin-1-yl)cyclohexyl]methanamine
PubChem CID64760563
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC Name[2,5-dimethyl-1-(2-methylpyrrolidin-1-yl)cyclohexyl]methanamine
SMILESCC1CCC(C)C(CN)(N2CCCC2C)C1
InChIInChI=1S/C14H28N2/c1-11-6-7-12(2)14(9-11,10-15)16-8-4-5-13(16)3/h11-13H,4-10,15H2,1-3H3
InChIKeyRRNBXVGMDIREJS-UHFFFAOYSA-N
XLogP2.62
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [2,5-dimethyl-1-(2-methylpyrrolidin-1-yl)cyclohexyl]methanamine?
The IUPAC name of [2,5-dimethyl-1-(2-methylpyrrolidin-1-yl)cyclohexyl]methanamine (CID 64760563) is [2,5-dimethyl-1-(2-methylpyrrolidin-1-yl)cyclohexyl]methanamine.
What is the SMILES notation for [2,5-dimethyl-1-(2-methylpyrrolidin-1-yl)cyclohexyl]methanamine?
The canonical SMILES for [2,5-dimethyl-1-(2-methylpyrrolidin-1-yl)cyclohexyl]methanamine is CC1CCC(C)C(CN)(N2CCCC2C)C1.
What is the InChIKey of [2,5-dimethyl-1-(2-methylpyrrolidin-1-yl)cyclohexyl]methanamine?
The InChIKey is RRNBXVGMDIREJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-11-6-7-12(2)14(9-11,10-15)16-8-4-5-13(16)3/h11-13H,4-10,15H2,1-3H3.
What are the key properties of [2,5-dimethyl-1-(2-methylpyrrolidin-1-yl)cyclohexyl]methanamine?
[2,5-dimethyl-1-(2-methylpyrrolidin-1-yl)cyclohexyl]methanamine has a molecular weight of 224.39 g/mol, XLogP of 2.62, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2,5-dimethyl-1-(2-methylpyrrolidin-1-yl)cyclohexyl]methanamine is sourced from PubChem (CID 64760563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).