1-cyclopentyl-N-(2-methylpropyl)-5-propan-2-ylpiperidin-3-amine

C17H34N2 — CID 83994520

IUPAC1-cyclopentyl-N-(2-methylpropyl)-5-propan-2-ylpiperidin-3-amine
SMILESCC(C)CNC1CC(C(C)C)CN(C2CCCC2)C1
InChIInChI=1S/C17H34N2/c1-13(2)10-18-16-9-15(14(3)4)11-19(12-16)17-7-5-6-8-17/h13-18H,5-12H2,1-4H3
InChIKeyNXQAKQHTQOFYCG-UHFFFAOYSA-N
MW266.47 g/mol
LogP3.52
Rot. Bonds5

About 1-cyclopentyl-N-(2-methylpropyl)-5-propan-2-ylpiperidin-3-amine

1-cyclopentyl-N-(2-methylpropyl)-5-propan-2-ylpiperidin-3-amine (PubChem CID 83994520) has the molecular formula C17H34N2 and a molecular weight of 266.47 g/mol. Its IUPAC name is 1-cyclopentyl-N-(2-methylpropyl)-5-propan-2-ylpiperidin-3-amine.

Molecular Properties

Compound Name1-cyclopentyl-N-(2-methylpropyl)-5-propan-2-ylpiperidin-3-amine
PubChem CID83994520
Molecular FormulaC17H34N2
Molecular Weight266.47 g/mol
Exact Mass266.27
IUPAC Name1-cyclopentyl-N-(2-methylpropyl)-5-propan-2-ylpiperidin-3-amine
SMILESCC(C)CNC1CC(C(C)C)CN(C2CCCC2)C1
InChIInChI=1S/C17H34N2/c1-13(2)10-18-16-9-15(14(3)4)11-19(12-16)17-7-5-6-8-17/h13-18H,5-12H2,1-4H3
InChIKeyNXQAKQHTQOFYCG-UHFFFAOYSA-N
XLogP3.52
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.47
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-N-(2-methylpropyl)-5-propan-2-ylpiperidin-3-amine?
The IUPAC name of 1-cyclopentyl-N-(2-methylpropyl)-5-propan-2-ylpiperidin-3-amine (CID 83994520) is 1-cyclopentyl-N-(2-methylpropyl)-5-propan-2-ylpiperidin-3-amine.
What is the SMILES notation for 1-cyclopentyl-N-(2-methylpropyl)-5-propan-2-ylpiperidin-3-amine?
The canonical SMILES for 1-cyclopentyl-N-(2-methylpropyl)-5-propan-2-ylpiperidin-3-amine is CC(C)CNC1CC(C(C)C)CN(C2CCCC2)C1.
What is the InChIKey of 1-cyclopentyl-N-(2-methylpropyl)-5-propan-2-ylpiperidin-3-amine?
The InChIKey is NXQAKQHTQOFYCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2/c1-13(2)10-18-16-9-15(14(3)4)11-19(12-16)17-7-5-6-8-17/h13-18H,5-12H2,1-4H3.
What are the key properties of 1-cyclopentyl-N-(2-methylpropyl)-5-propan-2-ylpiperidin-3-amine?
1-cyclopentyl-N-(2-methylpropyl)-5-propan-2-ylpiperidin-3-amine has a molecular weight of 266.47 g/mol, XLogP of 3.52, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-N-(2-methylpropyl)-5-propan-2-ylpiperidin-3-amine is sourced from PubChem (CID 83994520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).