1-tert-butyl-4-cyclopropylpiperidin-4-amine

C12H24N2 — CID 58315256

IUPAC1-tert-butyl-4-cyclopropylpiperidin-4-amine
SMILESCC(C)(C)N1CCC(N)(C2CC2)CC1
InChIInChI=1S/C12H24N2/c1-11(2,3)14-8-6-12(13,7-9-14)10-4-5-10/h10H,4-9,13H2,1-3H3
InChIKeyLFFITPXYHKPEQJ-UHFFFAOYSA-N
MW196.34 g/mol
LogP1.99
Rot. Bonds1

About 1-tert-butyl-4-cyclopropylpiperidin-4-amine

1-tert-butyl-4-cyclopropylpiperidin-4-amine (PubChem CID 58315256) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is 1-tert-butyl-4-cyclopropylpiperidin-4-amine.

Molecular Properties

Compound Name1-tert-butyl-4-cyclopropylpiperidin-4-amine
PubChem CID58315256
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC Name1-tert-butyl-4-cyclopropylpiperidin-4-amine
SMILESCC(C)(C)N1CCC(N)(C2CC2)CC1
InChIInChI=1S/C12H24N2/c1-11(2,3)14-8-6-12(13,7-9-14)10-4-5-10/h10H,4-9,13H2,1-3H3
InChIKeyLFFITPXYHKPEQJ-UHFFFAOYSA-N
XLogP1.99
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-tert-butyl-4-cyclopropylpiperidin-4-amine?
The IUPAC name of 1-tert-butyl-4-cyclopropylpiperidin-4-amine (CID 58315256) is 1-tert-butyl-4-cyclopropylpiperidin-4-amine.
What is the SMILES notation for 1-tert-butyl-4-cyclopropylpiperidin-4-amine?
The canonical SMILES for 1-tert-butyl-4-cyclopropylpiperidin-4-amine is CC(C)(C)N1CCC(N)(C2CC2)CC1.
What is the InChIKey of 1-tert-butyl-4-cyclopropylpiperidin-4-amine?
The InChIKey is LFFITPXYHKPEQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2/c1-11(2,3)14-8-6-12(13,7-9-14)10-4-5-10/h10H,4-9,13H2,1-3H3.
What are the key properties of 1-tert-butyl-4-cyclopropylpiperidin-4-amine?
1-tert-butyl-4-cyclopropylpiperidin-4-amine has a molecular weight of 196.34 g/mol, XLogP of 1.99, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-tert-butyl-4-cyclopropylpiperidin-4-amine is sourced from PubChem (CID 58315256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).