N-tert-butyl-2-(4-tert-butylpiperidin-1-yl)pentan-1-amine

C18H38N2 — CID 83042494

IUPACN-tert-butyl-2-(4-tert-butylpiperidin-1-yl)pentan-1-amine
SMILESCCCC(CNC(C)(C)C)N1CCC(C(C)(C)C)CC1
InChIInChI=1S/C18H38N2/c1-8-9-16(14-19-18(5,6)7)20-12-10-15(11-13-20)17(2,3)4/h15-16,19H,8-14H2,1-7H3
InChIKeyRDCJZTKRJAMEPG-UHFFFAOYSA-N
MW282.52 g/mol
LogP4.30
Rot. Bonds5

About N-tert-butyl-2-(4-tert-butylpiperidin-1-yl)pentan-1-amine

N-tert-butyl-2-(4-tert-butylpiperidin-1-yl)pentan-1-amine (PubChem CID 83042494) has the molecular formula C18H38N2 and a molecular weight of 282.52 g/mol. Its IUPAC name is N-tert-butyl-2-(4-tert-butylpiperidin-1-yl)pentan-1-amine.

Molecular Properties

Compound NameN-tert-butyl-2-(4-tert-butylpiperidin-1-yl)pentan-1-amine
PubChem CID83042494
Molecular FormulaC18H38N2
Molecular Weight282.52 g/mol
Exact Mass282.30
IUPAC NameN-tert-butyl-2-(4-tert-butylpiperidin-1-yl)pentan-1-amine
SMILESCCCC(CNC(C)(C)C)N1CCC(C(C)(C)C)CC1
InChIInChI=1S/C18H38N2/c1-8-9-16(14-19-18(5,6)7)20-12-10-15(11-13-20)17(2,3)4/h15-16,19H,8-14H2,1-7H3
InChIKeyRDCJZTKRJAMEPG-UHFFFAOYSA-N
XLogP4.30
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.52
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-tert-butyl-2-(4-methylsulfanylpiperidin-1-yl)pentan-1-amine
CID 114238325
N-tert-butyl-2-[4-[(dimethylamino)methyl]piperidin-1-yl]pentan-1-amine
CID 83054006
N-tert-butyl-2-(4-ethylazepan-1-yl)pentan-1-amine
CID 83055251
N-tert-butyl-2-(4-cyclopentylpiperazin-1-yl)pentan-1-amine
CID 83038989
N-tert-butyl-2-(4,4-diethylpiperidin-1-yl)pentan-1-amine
CID 83054955
N-tert-butyl-2-(4-ethyl-4-methylpiperidin-1-yl)pentan-1-amine
CID 83054505
2-(4-tert-butylpiperidin-1-yl)-3-methoxy-N-propylpropan-1-amine
CID 103225146
2-(4-tert-butylpiperidin-1-yl)-N-(2-methylpropyl)butan-1-amine
CID 55194853
N-tert-butyl-3-(4-tert-butylpiperidin-1-yl)-2-methylpropan-1-amine
CID 55070199
3-(4-tert-butylpiperidin-1-yl)-N-methylheptan-4-amine
CID 63468032
N-tert-butyl-2-(2-ethyl-5-methylpyrrolidin-1-yl)pentan-1-amine
CID 83221318
N-tert-butyl-2-(4-methylpiperazin-1-yl)butan-1-amine
CID 62438126

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-(4-tert-butylpiperidin-1-yl)pentan-1-amine?
The IUPAC name of N-tert-butyl-2-(4-tert-butylpiperidin-1-yl)pentan-1-amine (CID 83042494) is N-tert-butyl-2-(4-tert-butylpiperidin-1-yl)pentan-1-amine.
What is the SMILES notation for N-tert-butyl-2-(4-tert-butylpiperidin-1-yl)pentan-1-amine?
The canonical SMILES for N-tert-butyl-2-(4-tert-butylpiperidin-1-yl)pentan-1-amine is CCCC(CNC(C)(C)C)N1CCC(C(C)(C)C)CC1.
What is the InChIKey of N-tert-butyl-2-(4-tert-butylpiperidin-1-yl)pentan-1-amine?
The InChIKey is RDCJZTKRJAMEPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H38N2/c1-8-9-16(14-19-18(5,6)7)20-12-10-15(11-13-20)17(2,3)4/h15-16,19H,8-14H2,1-7H3.
What are the key properties of N-tert-butyl-2-(4-tert-butylpiperidin-1-yl)pentan-1-amine?
N-tert-butyl-2-(4-tert-butylpiperidin-1-yl)pentan-1-amine has a molecular weight of 282.52 g/mol, XLogP of 4.30, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-(4-tert-butylpiperidin-1-yl)pentan-1-amine is sourced from PubChem (CID 83042494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).