(1-piperidin-1-ylcycloheptyl)methanamine

C13H26N2 — CID 24703148

IUPAC(1-piperidin-1-ylcycloheptyl)methanamine
SMILESNCC1(N2CCCCC2)CCCCCC1
InChIInChI=1S/C13H26N2/c14-12-13(8-4-1-2-5-9-13)15-10-6-3-7-11-15/h1-12,14H2
InChIKeyCADFLHKZCPXBTB-UHFFFAOYSA-N
MW210.36 g/mol
LogP2.52
Rot. Bonds2

About (1-piperidin-1-ylcycloheptyl)methanamine

(1-piperidin-1-ylcycloheptyl)methanamine (PubChem CID 24703148) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is (1-piperidin-1-ylcycloheptyl)methanamine.

Molecular Properties

Compound Name(1-piperidin-1-ylcycloheptyl)methanamine
PubChem CID24703148
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC Name(1-piperidin-1-ylcycloheptyl)methanamine
SMILESNCC1(N2CCCCC2)CCCCCC1
InChIInChI=1S/C13H26N2/c14-12-13(8-4-1-2-5-9-13)15-10-6-3-7-11-15/h1-12,14H2
InChIKeyCADFLHKZCPXBTB-UHFFFAOYSA-N
XLogP2.52
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1-piperidin-1-ylcycloheptyl)methanamine?
The IUPAC name of (1-piperidin-1-ylcycloheptyl)methanamine (CID 24703148) is (1-piperidin-1-ylcycloheptyl)methanamine.
What is the SMILES notation for (1-piperidin-1-ylcycloheptyl)methanamine?
The canonical SMILES for (1-piperidin-1-ylcycloheptyl)methanamine is NCC1(N2CCCCC2)CCCCCC1.
What is the InChIKey of (1-piperidin-1-ylcycloheptyl)methanamine?
The InChIKey is CADFLHKZCPXBTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c14-12-13(8-4-1-2-5-9-13)15-10-6-3-7-11-15/h1-12,14H2.
What are the key properties of (1-piperidin-1-ylcycloheptyl)methanamine?
(1-piperidin-1-ylcycloheptyl)methanamine has a molecular weight of 210.36 g/mol, XLogP of 2.52, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-piperidin-1-ylcycloheptyl)methanamine is sourced from PubChem (CID 24703148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).