[1-(4-tert-butylpiperidin-1-yl)cyclohexyl]methanamine

C16H32N2 — CID 55032529

IUPAC[1-(4-tert-butylpiperidin-1-yl)cyclohexyl]methanamine
SMILESCC(C)(C)C1CCN(C2(CN)CCCCC2)CC1
InChIInChI=1S/C16H32N2/c1-15(2,3)14-7-11-18(12-8-14)16(13-17)9-5-4-6-10-16/h14H,4-13,17H2,1-3H3
InChIKeyFHSXWJPKACRKOV-UHFFFAOYSA-N
MW252.45 g/mol
LogP3.41
Rot. Bonds2

About [1-(4-tert-butylpiperidin-1-yl)cyclohexyl]methanamine

[1-(4-tert-butylpiperidin-1-yl)cyclohexyl]methanamine (PubChem CID 55032529) has the molecular formula C16H32N2 and a molecular weight of 252.45 g/mol. Its IUPAC name is [1-(4-tert-butylpiperidin-1-yl)cyclohexyl]methanamine.

Molecular Properties

Compound Name[1-(4-tert-butylpiperidin-1-yl)cyclohexyl]methanamine
PubChem CID55032529
Molecular FormulaC16H32N2
Molecular Weight252.45 g/mol
Exact Mass252.26
IUPAC Name[1-(4-tert-butylpiperidin-1-yl)cyclohexyl]methanamine
SMILESCC(C)(C)C1CCN(C2(CN)CCCCC2)CC1
InChIInChI=1S/C16H32N2/c1-15(2,3)14-7-11-18(12-8-14)16(13-17)9-5-4-6-10-16/h14H,4-13,17H2,1-3H3
InChIKeyFHSXWJPKACRKOV-UHFFFAOYSA-N
XLogP3.41
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.45
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [1-(4-tert-butylpiperidin-1-yl)cyclohexyl]methanamine?
The IUPAC name of [1-(4-tert-butylpiperidin-1-yl)cyclohexyl]methanamine (CID 55032529) is [1-(4-tert-butylpiperidin-1-yl)cyclohexyl]methanamine.
What is the SMILES notation for [1-(4-tert-butylpiperidin-1-yl)cyclohexyl]methanamine?
The canonical SMILES for [1-(4-tert-butylpiperidin-1-yl)cyclohexyl]methanamine is CC(C)(C)C1CCN(C2(CN)CCCCC2)CC1.
What is the InChIKey of [1-(4-tert-butylpiperidin-1-yl)cyclohexyl]methanamine?
The InChIKey is FHSXWJPKACRKOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2/c1-15(2,3)14-7-11-18(12-8-14)16(13-17)9-5-4-6-10-16/h14H,4-13,17H2,1-3H3.
What are the key properties of [1-(4-tert-butylpiperidin-1-yl)cyclohexyl]methanamine?
[1-(4-tert-butylpiperidin-1-yl)cyclohexyl]methanamine has a molecular weight of 252.45 g/mol, XLogP of 3.41, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-tert-butylpiperidin-1-yl)cyclohexyl]methanamine is sourced from PubChem (CID 55032529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).