2-(4-tert-butylpiperidin-1-yl)-2-(4-ethylphenyl)ethanamine

C19H32N2 — CID 63465065

IUPAC2-(4-tert-butylpiperidin-1-yl)-2-(4-ethylphenyl)ethanamine
SMILESCCc1ccc(C(CN)N2CCC(C(C)(C)C)CC2)cc1
InChIInChI=1S/C19H32N2/c1-5-15-6-8-16(9-7-15)18(14-20)21-12-10-17(11-13-21)19(2,3)4/h6-9,17-18H,5,10-14,20H2,1-4H3
InChIKeyKIWCQJDMLLAHRL-UHFFFAOYSA-N
MW288.48 g/mol
LogP4.01
Rot. Bonds4

About 2-(4-tert-butylpiperidin-1-yl)-2-(4-ethylphenyl)ethanamine

2-(4-tert-butylpiperidin-1-yl)-2-(4-ethylphenyl)ethanamine (PubChem CID 63465065) has the molecular formula C19H32N2 and a molecular weight of 288.48 g/mol. Its IUPAC name is 2-(4-tert-butylpiperidin-1-yl)-2-(4-ethylphenyl)ethanamine.

Molecular Properties

Compound Name2-(4-tert-butylpiperidin-1-yl)-2-(4-ethylphenyl)ethanamine
PubChem CID63465065
Molecular FormulaC19H32N2
Molecular Weight288.48 g/mol
Exact Mass288.26
IUPAC Name2-(4-tert-butylpiperidin-1-yl)-2-(4-ethylphenyl)ethanamine
SMILESCCc1ccc(C(CN)N2CCC(C(C)(C)C)CC2)cc1
InChIInChI=1S/C19H32N2/c1-5-15-6-8-16(9-7-15)18(14-20)21-12-10-17(11-13-21)19(2,3)4/h6-9,17-18H,5,10-14,20H2,1-4H3
InChIKeyKIWCQJDMLLAHRL-UHFFFAOYSA-N
XLogP4.01
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.48
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-tert-butylpiperidin-1-yl)-2-(4-fluorophenyl)ethanamine
CID 62089855
(2R)-2-(4-ethylphenyl)-2-pyrrolidin-1-ylethanamine
CID 97182150
(2S)-2-(4-ethylphenyl)-2-piperidin-1-ylethanamine
CID 97182151
2-(4-tert-butylphenyl)-2-(4-methylpiperidin-1-yl)ethanamine
CID 16642740
2-(4-tert-butylpiperidin-1-yl)-2-(5-methylthiophen-2-yl)ethanamine
CID 55032386
2-(4-ethylphenyl)-2-(4-phenylpiperazin-1-yl)ethanamine
CID 16642722
2-(4-tert-butylpiperidin-1-yl)-2-(2,3-difluorophenyl)ethanamine
CID 63669113
2-(4-tert-butylpiperidin-1-yl)-2-(4-chlorothiophen-2-yl)ethanamine
CID 79426847
[(4-tert-butylcyclohexyl)-(4-ethylphenyl)methyl]hydrazine
CID 105232777
2-(4-bromophenyl)-2-(4-ethylpiperidin-1-yl)ethanamine
CID 61421143
1-[2-amino-1-(4-methylphenyl)ethyl]piperidin-4-ol
CID 55016646
1-[2-amino-1-[4-(dimethylamino)phenyl]ethyl]piperidin-4-ol
CID 82020204

Frequently Asked Questions

What is the IUPAC name of 2-(4-tert-butylpiperidin-1-yl)-2-(4-ethylphenyl)ethanamine?
The IUPAC name of 2-(4-tert-butylpiperidin-1-yl)-2-(4-ethylphenyl)ethanamine (CID 63465065) is 2-(4-tert-butylpiperidin-1-yl)-2-(4-ethylphenyl)ethanamine.
What is the SMILES notation for 2-(4-tert-butylpiperidin-1-yl)-2-(4-ethylphenyl)ethanamine?
The canonical SMILES for 2-(4-tert-butylpiperidin-1-yl)-2-(4-ethylphenyl)ethanamine is CCc1ccc(C(CN)N2CCC(C(C)(C)C)CC2)cc1.
What is the InChIKey of 2-(4-tert-butylpiperidin-1-yl)-2-(4-ethylphenyl)ethanamine?
The InChIKey is KIWCQJDMLLAHRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H32N2/c1-5-15-6-8-16(9-7-15)18(14-20)21-12-10-17(11-13-21)19(2,3)4/h6-9,17-18H,5,10-14,20H2,1-4H3.
What are the key properties of 2-(4-tert-butylpiperidin-1-yl)-2-(4-ethylphenyl)ethanamine?
2-(4-tert-butylpiperidin-1-yl)-2-(4-ethylphenyl)ethanamine has a molecular weight of 288.48 g/mol, XLogP of 4.01, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-tert-butylpiperidin-1-yl)-2-(4-ethylphenyl)ethanamine is sourced from PubChem (CID 63465065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).