4-(4-tert-butylpiperidin-1-yl)pentan-1-amine

C14H30N2 — CID 62411940

IUPAC4-(4-tert-butylpiperidin-1-yl)pentan-1-amine
SMILESCC(CCCN)N1CCC(C(C)(C)C)CC1
InChIInChI=1S/C14H30N2/c1-12(6-5-9-15)16-10-7-13(8-11-16)14(2,3)4/h12-13H,5-11,15H2,1-4H3
InChIKeyRXUGWODRXSJIKM-UHFFFAOYSA-N
MW226.41 g/mol
LogP2.87
Rot. Bonds4

About 4-(4-tert-butylpiperidin-1-yl)pentan-1-amine

4-(4-tert-butylpiperidin-1-yl)pentan-1-amine (PubChem CID 62411940) has the molecular formula C14H30N2 and a molecular weight of 226.41 g/mol. Its IUPAC name is 4-(4-tert-butylpiperidin-1-yl)pentan-1-amine.

Molecular Properties

Compound Name4-(4-tert-butylpiperidin-1-yl)pentan-1-amine
PubChem CID62411940
Molecular FormulaC14H30N2
Molecular Weight226.41 g/mol
Exact Mass226.24
IUPAC Name4-(4-tert-butylpiperidin-1-yl)pentan-1-amine
SMILESCC(CCCN)N1CCC(C(C)(C)C)CC1
InChIInChI=1S/C14H30N2/c1-12(6-5-9-15)16-10-7-13(8-11-16)14(2,3)4/h12-13H,5-11,15H2,1-4H3
InChIKeyRXUGWODRXSJIKM-UHFFFAOYSA-N
XLogP2.87
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.41
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(4-tert-butylpiperidin-1-yl)pentan-1-amine?
The IUPAC name of 4-(4-tert-butylpiperidin-1-yl)pentan-1-amine (CID 62411940) is 4-(4-tert-butylpiperidin-1-yl)pentan-1-amine.
What is the SMILES notation for 4-(4-tert-butylpiperidin-1-yl)pentan-1-amine?
The canonical SMILES for 4-(4-tert-butylpiperidin-1-yl)pentan-1-amine is CC(CCCN)N1CCC(C(C)(C)C)CC1.
What is the InChIKey of 4-(4-tert-butylpiperidin-1-yl)pentan-1-amine?
The InChIKey is RXUGWODRXSJIKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2/c1-12(6-5-9-15)16-10-7-13(8-11-16)14(2,3)4/h12-13H,5-11,15H2,1-4H3.
What are the key properties of 4-(4-tert-butylpiperidin-1-yl)pentan-1-amine?
4-(4-tert-butylpiperidin-1-yl)pentan-1-amine has a molecular weight of 226.41 g/mol, XLogP of 2.87, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-tert-butylpiperidin-1-yl)pentan-1-amine is sourced from PubChem (CID 62411940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).