1-(5-tert-butyl-2-pyridinyl)-N-ethylpiperidin-4-amine

C16H27N3 — CID 107874233

IUPAC1-(5-tert-butyl-2-pyridinyl)-N-ethylpiperidin-4-amine
SMILESCCNC1CCN(c2ccc(C(C)(C)C)cn2)CC1
InChIInChI=1S/C16H27N3/c1-5-17-14-8-10-19(11-9-14)15-7-6-13(12-18-15)16(2,3)4/h6-7,12,14,17H,5,8-11H2,1-4H3
InChIKeyODRGRRIKFZEJLO-UHFFFAOYSA-N
MW261.41 g/mol
LogP2.96
Rot. Bonds3

About 1-(5-tert-butyl-2-pyridinyl)-N-ethylpiperidin-4-amine

1-(5-tert-butyl-2-pyridinyl)-N-ethylpiperidin-4-amine (PubChem CID 107874233) has the molecular formula C16H27N3 and a molecular weight of 261.41 g/mol. Its IUPAC name is 1-(5-tert-butyl-2-pyridinyl)-N-ethylpiperidin-4-amine.

Molecular Properties

Compound Name1-(5-tert-butyl-2-pyridinyl)-N-ethylpiperidin-4-amine
PubChem CID107874233
Molecular FormulaC16H27N3
Molecular Weight261.41 g/mol
Exact Mass261.22
IUPAC Name1-(5-tert-butyl-2-pyridinyl)-N-ethylpiperidin-4-amine
SMILESCCNC1CCN(c2ccc(C(C)(C)C)cn2)CC1
InChIInChI=1S/C16H27N3/c1-5-17-14-8-10-19(11-9-14)15-7-6-13(12-18-15)16(2,3)4/h6-7,12,14,17H,5,8-11H2,1-4H3
InChIKeyODRGRRIKFZEJLO-UHFFFAOYSA-N
XLogP2.96
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.41
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(5-tert-butyl-2-pyridinyl)-N-propylpiperidin-4-amine
CID 107874234
5-tert-butyl-2-[4-(1-chloroethyl)piperidin-1-yl]pyridine
CID 107875656
1-(5-tert-butyl-2-pyridinyl)-4-ethylpiperazine
CID 59019183
N-tert-butyl-1-(5-tert-butyl-2-pyridinyl)azetidin-3-amine
CID 126654405
1-(5-tert-butyl-2-pyridinyl)-4-methylpiperazine
CID 58798727
5-tert-butyl-2-[4-(2-chloroethoxy)piperidin-1-yl]pyridine
CID 107875613
N-[[1-[5-(trifluoromethyl)-2-pyridinyl]piperidin-4-yl]methyl]cyclopropanamine
CID 62592662
2-[1-(5-tert-butyl-2-pyridinyl)piperidin-4-yl]oxyethanamine
CID 107875698
N-benzyl-1-[5-(trifluoromethyl)-2-pyridinyl]piperidin-4-amine
CID 119111040
2-(4-tert-butylphenoxy)-N-[1-[5-(trifluoromethyl)-2-pyridinyl]piperidin-4-yl]acetamide
CID 55708412
5-tert-butyl-2-(4,4-difluoropiperidin-1-yl)pyridine
CID 155742359
N-(1,2-oxazol-3-ylmethyl)-1-[5-(trifluoromethyl)-2-pyridinyl]piperidin-4-amine
CID 86283936

Frequently Asked Questions

What is the IUPAC name of 1-(5-tert-butyl-2-pyridinyl)-N-ethylpiperidin-4-amine?
The IUPAC name of 1-(5-tert-butyl-2-pyridinyl)-N-ethylpiperidin-4-amine (CID 107874233) is 1-(5-tert-butyl-2-pyridinyl)-N-ethylpiperidin-4-amine.
What is the SMILES notation for 1-(5-tert-butyl-2-pyridinyl)-N-ethylpiperidin-4-amine?
The canonical SMILES for 1-(5-tert-butyl-2-pyridinyl)-N-ethylpiperidin-4-amine is CCNC1CCN(c2ccc(C(C)(C)C)cn2)CC1.
What is the InChIKey of 1-(5-tert-butyl-2-pyridinyl)-N-ethylpiperidin-4-amine?
The InChIKey is ODRGRRIKFZEJLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3/c1-5-17-14-8-10-19(11-9-14)15-7-6-13(12-18-15)16(2,3)4/h6-7,12,14,17H,5,8-11H2,1-4H3.
What are the key properties of 1-(5-tert-butyl-2-pyridinyl)-N-ethylpiperidin-4-amine?
1-(5-tert-butyl-2-pyridinyl)-N-ethylpiperidin-4-amine has a molecular weight of 261.41 g/mol, XLogP of 2.96, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-tert-butyl-2-pyridinyl)-N-ethylpiperidin-4-amine is sourced from PubChem (CID 107874233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).