1-cycloheptyl-2-methyl-2-piperidin-1-ylpropan-1-amine

C16H32N2 — CID 82932107

IUPAC1-cycloheptyl-2-methyl-2-piperidin-1-ylpropan-1-amine
SMILESCC(C)(C(N)C1CCCCCC1)N1CCCCC1
InChIInChI=1S/C16H32N2/c1-16(2,18-12-8-5-9-13-18)15(17)14-10-6-3-4-7-11-14/h14-15H,3-13,17H2,1-2H3
InChIKeyMDOWYTUIOTUUAL-UHFFFAOYSA-N
MW252.45 g/mol
LogP3.55
Rot. Bonds3

About 1-cycloheptyl-2-methyl-2-piperidin-1-ylpropan-1-amine

1-cycloheptyl-2-methyl-2-piperidin-1-ylpropan-1-amine (PubChem CID 82932107) has the molecular formula C16H32N2 and a molecular weight of 252.45 g/mol. Its IUPAC name is 1-cycloheptyl-2-methyl-2-piperidin-1-ylpropan-1-amine.

Molecular Properties

Compound Name1-cycloheptyl-2-methyl-2-piperidin-1-ylpropan-1-amine
PubChem CID82932107
Molecular FormulaC16H32N2
Molecular Weight252.45 g/mol
Exact Mass252.26
IUPAC Name1-cycloheptyl-2-methyl-2-piperidin-1-ylpropan-1-amine
SMILESCC(C)(C(N)C1CCCCCC1)N1CCCCC1
InChIInChI=1S/C16H32N2/c1-16(2,18-12-8-5-9-13-18)15(17)14-10-6-3-4-7-11-14/h14-15H,3-13,17H2,1-2H3
InChIKeyMDOWYTUIOTUUAL-UHFFFAOYSA-N
XLogP3.55
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.45
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cycloheptyl-2-methyl-2-piperidin-1-ylpropan-1-amine?
The IUPAC name of 1-cycloheptyl-2-methyl-2-piperidin-1-ylpropan-1-amine (CID 82932107) is 1-cycloheptyl-2-methyl-2-piperidin-1-ylpropan-1-amine.
What is the SMILES notation for 1-cycloheptyl-2-methyl-2-piperidin-1-ylpropan-1-amine?
The canonical SMILES for 1-cycloheptyl-2-methyl-2-piperidin-1-ylpropan-1-amine is CC(C)(C(N)C1CCCCCC1)N1CCCCC1.
What is the InChIKey of 1-cycloheptyl-2-methyl-2-piperidin-1-ylpropan-1-amine?
The InChIKey is MDOWYTUIOTUUAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2/c1-16(2,18-12-8-5-9-13-18)15(17)14-10-6-3-4-7-11-14/h14-15H,3-13,17H2,1-2H3.
What are the key properties of 1-cycloheptyl-2-methyl-2-piperidin-1-ylpropan-1-amine?
1-cycloheptyl-2-methyl-2-piperidin-1-ylpropan-1-amine has a molecular weight of 252.45 g/mol, XLogP of 3.55, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cycloheptyl-2-methyl-2-piperidin-1-ylpropan-1-amine is sourced from PubChem (CID 82932107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).