[1-methyl-3-(3,4,4,5-tetramethylpiperidin-1-yl)cyclopentyl]methanamine

C16H32N2 — CID 59888760

IUPAC[1-methyl-3-(3,4,4,5-tetramethylpiperidin-1-yl)cyclopentyl]methanamine
SMILESCC1CN(C2CCC(C)(CN)C2)CC(C)C1(C)C
InChIInChI=1S/C16H32N2/c1-12-9-18(10-13(2)15(12,3)4)14-6-7-16(5,8-14)11-17/h12-14H,6-11,17H2,1-5H3
InChIKeyLNAIVGWXBOIPDX-UHFFFAOYSA-N
MW252.45 g/mol
LogP3.12
Rot. Bonds2

About [1-methyl-3-(3,4,4,5-tetramethylpiperidin-1-yl)cyclopentyl]methanamine

[1-methyl-3-(3,4,4,5-tetramethylpiperidin-1-yl)cyclopentyl]methanamine (PubChem CID 59888760) has the molecular formula C16H32N2 and a molecular weight of 252.45 g/mol. Its IUPAC name is [1-methyl-3-(3,4,4,5-tetramethylpiperidin-1-yl)cyclopentyl]methanamine.

Molecular Properties

Compound Name[1-methyl-3-(3,4,4,5-tetramethylpiperidin-1-yl)cyclopentyl]methanamine
PubChem CID59888760
Molecular FormulaC16H32N2
Molecular Weight252.45 g/mol
Exact Mass252.26
IUPAC Name[1-methyl-3-(3,4,4,5-tetramethylpiperidin-1-yl)cyclopentyl]methanamine
SMILESCC1CN(C2CCC(C)(CN)C2)CC(C)C1(C)C
InChIInChI=1S/C16H32N2/c1-12-9-18(10-13(2)15(12,3)4)14-6-7-16(5,8-14)11-17/h12-14H,6-11,17H2,1-5H3
InChIKeyLNAIVGWXBOIPDX-UHFFFAOYSA-N
XLogP3.12
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.45
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [1-methyl-3-(3,4,4,5-tetramethylpiperidin-1-yl)cyclopentyl]methanamine?
The IUPAC name of [1-methyl-3-(3,4,4,5-tetramethylpiperidin-1-yl)cyclopentyl]methanamine (CID 59888760) is [1-methyl-3-(3,4,4,5-tetramethylpiperidin-1-yl)cyclopentyl]methanamine.
What is the SMILES notation for [1-methyl-3-(3,4,4,5-tetramethylpiperidin-1-yl)cyclopentyl]methanamine?
The canonical SMILES for [1-methyl-3-(3,4,4,5-tetramethylpiperidin-1-yl)cyclopentyl]methanamine is CC1CN(C2CCC(C)(CN)C2)CC(C)C1(C)C.
What is the InChIKey of [1-methyl-3-(3,4,4,5-tetramethylpiperidin-1-yl)cyclopentyl]methanamine?
The InChIKey is LNAIVGWXBOIPDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2/c1-12-9-18(10-13(2)15(12,3)4)14-6-7-16(5,8-14)11-17/h12-14H,6-11,17H2,1-5H3.
What are the key properties of [1-methyl-3-(3,4,4,5-tetramethylpiperidin-1-yl)cyclopentyl]methanamine?
[1-methyl-3-(3,4,4,5-tetramethylpiperidin-1-yl)cyclopentyl]methanamine has a molecular weight of 252.45 g/mol, XLogP of 3.12, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-methyl-3-(3,4,4,5-tetramethylpiperidin-1-yl)cyclopentyl]methanamine is sourced from PubChem (CID 59888760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).