N-ethyl-4-(3-ethylpiperidin-1-yl)-3,3-dimethylbutan-2-amine

C15H32N2 — CID 66455139

IUPACN-ethyl-4-(3-ethylpiperidin-1-yl)-3,3-dimethylbutan-2-amine
SMILESCCNC(C)C(C)(C)CN1CCCC(CC)C1
InChIInChI=1S/C15H32N2/c1-6-14-9-8-10-17(11-14)12-15(4,5)13(3)16-7-2/h13-14,16H,6-12H2,1-5H3
InChIKeyIKRGFAXESRFRLU-UHFFFAOYSA-N
MW240.43 g/mol
LogP3.13
Rot. Bonds6

About N-ethyl-4-(3-ethylpiperidin-1-yl)-3,3-dimethylbutan-2-amine

N-ethyl-4-(3-ethylpiperidin-1-yl)-3,3-dimethylbutan-2-amine (PubChem CID 66455139) has the molecular formula C15H32N2 and a molecular weight of 240.43 g/mol. Its IUPAC name is N-ethyl-4-(3-ethylpiperidin-1-yl)-3,3-dimethylbutan-2-amine.

Molecular Properties

Compound NameN-ethyl-4-(3-ethylpiperidin-1-yl)-3,3-dimethylbutan-2-amine
PubChem CID66455139
Molecular FormulaC15H32N2
Molecular Weight240.43 g/mol
Exact Mass240.26
IUPAC NameN-ethyl-4-(3-ethylpiperidin-1-yl)-3,3-dimethylbutan-2-amine
SMILESCCNC(C)C(C)(C)CN1CCCC(CC)C1
InChIInChI=1S/C15H32N2/c1-6-14-9-8-10-17(11-14)12-15(4,5)13(3)16-7-2/h13-14,16H,6-12H2,1-5H3
InChIKeyIKRGFAXESRFRLU-UHFFFAOYSA-N
XLogP3.13
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.43
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(3-ethylpiperidin-1-yl)-3,3-dimethylbutan-2-amine
CID 66454924
3-ethyl-1-(2,2,3,4-tetramethylpentyl)piperidine
CID 134317869
1-[3-(ethylamino)-2,2-dimethylbutyl]-3-methylpiperidin-4-ol
CID 114681950
1-(3-ethylpiperidin-1-yl)-2,3-dimethylbutan-2-ol
CID 114447622
N-ethyl-3-(3-ethylpiperidin-1-yl)-2,2-dimethylpropan-1-amine
CID 62257877
2-[1-[2,2-dimethyl-3-(methylamino)butyl]piperidin-3-yl]ethanol
CID 107228991
4-(3-ethylpiperidin-1-yl)-3,3-dimethylbutan-2-one
CID 66453803
1-(3-ethylpiperidin-1-yl)-2-methylbutan-2-ol
CID 114495376
N-ethyl-3,3-dimethyl-4-(2-propan-2-ylpyrrolidin-1-yl)butan-2-amine
CID 66452820
N-ethyl-1-(3-ethylpiperidin-1-yl)-3-methoxypropan-2-amine
CID 107505415
N-ethyl-3,3-dimethyl-4-(4-methylpiperazin-1-yl)butan-2-amine
CID 66453823
4-(2,3-dimethylpiperidin-1-yl)-N-ethyl-3,3-dimethylbutan-2-amine
CID 66455577

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-(3-ethylpiperidin-1-yl)-3,3-dimethylbutan-2-amine?
The IUPAC name of N-ethyl-4-(3-ethylpiperidin-1-yl)-3,3-dimethylbutan-2-amine (CID 66455139) is N-ethyl-4-(3-ethylpiperidin-1-yl)-3,3-dimethylbutan-2-amine.
What is the SMILES notation for N-ethyl-4-(3-ethylpiperidin-1-yl)-3,3-dimethylbutan-2-amine?
The canonical SMILES for N-ethyl-4-(3-ethylpiperidin-1-yl)-3,3-dimethylbutan-2-amine is CCNC(C)C(C)(C)CN1CCCC(CC)C1.
What is the InChIKey of N-ethyl-4-(3-ethylpiperidin-1-yl)-3,3-dimethylbutan-2-amine?
The InChIKey is IKRGFAXESRFRLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2/c1-6-14-9-8-10-17(11-14)12-15(4,5)13(3)16-7-2/h13-14,16H,6-12H2,1-5H3.
What are the key properties of N-ethyl-4-(3-ethylpiperidin-1-yl)-3,3-dimethylbutan-2-amine?
N-ethyl-4-(3-ethylpiperidin-1-yl)-3,3-dimethylbutan-2-amine has a molecular weight of 240.43 g/mol, XLogP of 3.13, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-(3-ethylpiperidin-1-yl)-3,3-dimethylbutan-2-amine is sourced from PubChem (CID 66455139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).