1-[(4-methylidenepiperidin-1-yl)methyl]cyclopentan-1-amine

C12H22N2 — CID 130765907

IUPAC1-[(4-methylidenepiperidin-1-yl)methyl]cyclopentan-1-amine
SMILESC=C1CCN(CC2(N)CCCC2)CC1
InChIInChI=1S/C12H22N2/c1-11-4-8-14(9-5-11)10-12(13)6-2-3-7-12/h1-10,13H2
InChIKeyXBWZTHDCHVSPGI-UHFFFAOYSA-N
MW194.32 g/mol
LogP1.91
Rot. Bonds2

About 1-[(4-methylidenepiperidin-1-yl)methyl]cyclopentan-1-amine

1-[(4-methylidenepiperidin-1-yl)methyl]cyclopentan-1-amine (PubChem CID 130765907) has the molecular formula C12H22N2 and a molecular weight of 194.32 g/mol. Its IUPAC name is 1-[(4-methylidenepiperidin-1-yl)methyl]cyclopentan-1-amine.

Molecular Properties

Compound Name1-[(4-methylidenepiperidin-1-yl)methyl]cyclopentan-1-amine
PubChem CID130765907
Molecular FormulaC12H22N2
Molecular Weight194.32 g/mol
Exact Mass194.18
IUPAC Name1-[(4-methylidenepiperidin-1-yl)methyl]cyclopentan-1-amine
SMILESC=C1CCN(CC2(N)CCCC2)CC1
InChIInChI=1S/C12H22N2/c1-11-4-8-14(9-5-11)10-12(13)6-2-3-7-12/h1-10,13H2
InChIKeyXBWZTHDCHVSPGI-UHFFFAOYSA-N
XLogP1.91
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.32
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-[(4-methylidenepiperidin-1-yl)methyl]cyclopentan-1-amine?
The IUPAC name of 1-[(4-methylidenepiperidin-1-yl)methyl]cyclopentan-1-amine (CID 130765907) is 1-[(4-methylidenepiperidin-1-yl)methyl]cyclopentan-1-amine.
What is the SMILES notation for 1-[(4-methylidenepiperidin-1-yl)methyl]cyclopentan-1-amine?
The canonical SMILES for 1-[(4-methylidenepiperidin-1-yl)methyl]cyclopentan-1-amine is C=C1CCN(CC2(N)CCCC2)CC1.
What is the InChIKey of 1-[(4-methylidenepiperidin-1-yl)methyl]cyclopentan-1-amine?
The InChIKey is XBWZTHDCHVSPGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2/c1-11-4-8-14(9-5-11)10-12(13)6-2-3-7-12/h1-10,13H2.
What are the key properties of 1-[(4-methylidenepiperidin-1-yl)methyl]cyclopentan-1-amine?
1-[(4-methylidenepiperidin-1-yl)methyl]cyclopentan-1-amine has a molecular weight of 194.32 g/mol, XLogP of 1.91, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-methylidenepiperidin-1-yl)methyl]cyclopentan-1-amine is sourced from PubChem (CID 130765907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).