3-ethyl-1-(2-phenylpropyl)piperidin-4-amine

C16H26N2 — CID 81456838

IUPAC3-ethyl-1-(2-phenylpropyl)piperidin-4-amine
SMILESCCC1CN(CC(C)c2ccccc2)CCC1N
InChIInChI=1S/C16H26N2/c1-3-14-12-18(10-9-16(14)17)11-13(2)15-7-5-4-6-8-15/h4-8,13-14,16H,3,9-12,17H2,1-2H3
InChIKeyNBQCEFFTKRCJCF-UHFFFAOYSA-N
MW246.40 g/mol
LogP2.85
Rot. Bonds4

About 3-ethyl-1-(2-phenylpropyl)piperidin-4-amine

3-ethyl-1-(2-phenylpropyl)piperidin-4-amine (PubChem CID 81456838) has the molecular formula C16H26N2 and a molecular weight of 246.40 g/mol. Its IUPAC name is 3-ethyl-1-(2-phenylpropyl)piperidin-4-amine.

Molecular Properties

Compound Name3-ethyl-1-(2-phenylpropyl)piperidin-4-amine
PubChem CID81456838
Molecular FormulaC16H26N2
Molecular Weight246.40 g/mol
Exact Mass246.21
IUPAC Name3-ethyl-1-(2-phenylpropyl)piperidin-4-amine
SMILESCCC1CN(CC(C)c2ccccc2)CCC1N
InChIInChI=1S/C16H26N2/c1-3-14-12-18(10-9-16(14)17)11-13(2)15-7-5-4-6-8-15/h4-8,13-14,16H,3,9-12,17H2,1-2H3
InChIKeyNBQCEFFTKRCJCF-UHFFFAOYSA-N
XLogP2.85
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.40
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-methyl-1-(2-phenylpropyl)piperidin-4-amine
CID 79879108
(3R)-1-[(2S)-2-phenylpropyl]pyrrolidine-3-carboxylic acid
CID 129413679
N-[[1-(2-phenylpropyl)pyrrolidin-3-yl]methyl]ethanamine
CID 113430223
6-ethyl-3-methyl-1-(2-phenylpropyl)-1,5-diazocane
CID 104592186
3-ethyl-1-[(4-propan-2-ylphenyl)methyl]piperidin-4-amine
CID 81457375
N-methyl-1-(2-phenylpropyl)piperidin-3-amine
CID 55086340
1-(4-amino-3-ethylpiperidin-1-yl)butan-2-ol
CID 81458861
3-ethyl-1-(pyrimidin-2-ylmethyl)piperidin-4-amine
CID 81460638
3-methyl-1-(2-phenylpropyl)piperazine
CID 65416584
[(3R)-1-[(2S)-2-phenylpropyl]piperidin-3-yl]methanol
CID 129425520
1-(2-phenylpropyl)azetidin-3-ol
CID 121200321
3-ethyl-1-(3-methylbutyl)piperidin-4-amine
CID 81457708

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-(2-phenylpropyl)piperidin-4-amine?
The IUPAC name of 3-ethyl-1-(2-phenylpropyl)piperidin-4-amine (CID 81456838) is 3-ethyl-1-(2-phenylpropyl)piperidin-4-amine.
What is the SMILES notation for 3-ethyl-1-(2-phenylpropyl)piperidin-4-amine?
The canonical SMILES for 3-ethyl-1-(2-phenylpropyl)piperidin-4-amine is CCC1CN(CC(C)c2ccccc2)CCC1N.
What is the InChIKey of 3-ethyl-1-(2-phenylpropyl)piperidin-4-amine?
The InChIKey is NBQCEFFTKRCJCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2/c1-3-14-12-18(10-9-16(14)17)11-13(2)15-7-5-4-6-8-15/h4-8,13-14,16H,3,9-12,17H2,1-2H3.
What are the key properties of 3-ethyl-1-(2-phenylpropyl)piperidin-4-amine?
3-ethyl-1-(2-phenylpropyl)piperidin-4-amine has a molecular weight of 246.40 g/mol, XLogP of 2.85, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-(2-phenylpropyl)piperidin-4-amine is sourced from PubChem (CID 81456838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).