3-(ethylamino)-2-methyl-1-(2-propylpiperidin-1-yl)propan-1-one

C14H28N2O — CID 83052878

IUPAC3-(ethylamino)-2-methyl-1-(2-propylpiperidin-1-yl)propan-1-one
SMILESCCCC1CCCCN1C(=O)C(C)CNCC
InChIInChI=1S/C14H28N2O/c1-4-8-13-9-6-7-10-16(13)14(17)12(3)11-15-5-2/h12-13,15H,4-11H2,1-3H3
InChIKeyCGBAUUIYRCZONK-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.41
Rot. Bonds6

About 3-(ethylamino)-2-methyl-1-(2-propylpiperidin-1-yl)propan-1-one

3-(ethylamino)-2-methyl-1-(2-propylpiperidin-1-yl)propan-1-one (PubChem CID 83052878) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 3-(ethylamino)-2-methyl-1-(2-propylpiperidin-1-yl)propan-1-one.

Molecular Properties

Compound Name3-(ethylamino)-2-methyl-1-(2-propylpiperidin-1-yl)propan-1-one
PubChem CID83052878
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name3-(ethylamino)-2-methyl-1-(2-propylpiperidin-1-yl)propan-1-one
SMILESCCCC1CCCCN1C(=O)C(C)CNCC
InChIInChI=1S/C14H28N2O/c1-4-8-13-9-6-7-10-16(13)14(17)12(3)11-15-5-2/h12-13,15H,4-11H2,1-3H3
InChIKeyCGBAUUIYRCZONK-UHFFFAOYSA-N
XLogP2.41
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(ethylamino)-1-(2-ethylazepan-1-yl)-2-methylpropan-1-one
CID 104689693
3-(ethylamino)-1-[2-(hydroxymethyl)pyrrolidin-1-yl]-2-methylpropan-1-one
CID 62839819
6-amino-2-methyl-1-(2-propylpiperidin-1-yl)heptan-1-one
CID 83053688
1-[3-(ethylamino)-2-methylpropanoyl]azepane-2-carboxylic acid
CID 64564263
1-[2-(2-chloroethyl)piperidin-1-yl]-2-methylpentan-1-one
CID 63393873
(2R)-1-[(2R)-2-ethylpiperidin-1-yl]-2-methylpentan-1-one
CID 875586
1-(2-ethylazepan-1-yl)-2-methyl-3-(methylamino)propan-1-one;hydrochloride
CID 119793413
(2S,3S)-2-amino-3-methyl-1-(2-propylpiperidin-1-yl)pentan-1-one
CID 83052045
2-methyl-1-[2-(2-oxopropyl)piperidin-1-yl]butan-1-one
CID 79549033
1-(azocan-1-yl)-3-(ethylamino)-2-methylpropan-1-one
CID 62852509
3-[methyl-(2-propylpiperidine-1-carbonyl)amino]propanoic acid
CID 83055352
N-ethyl-2-propylpiperidine-1-carbothioamide
CID 104587652

Frequently Asked Questions

What is the IUPAC name of 3-(ethylamino)-2-methyl-1-(2-propylpiperidin-1-yl)propan-1-one?
The IUPAC name of 3-(ethylamino)-2-methyl-1-(2-propylpiperidin-1-yl)propan-1-one (CID 83052878) is 3-(ethylamino)-2-methyl-1-(2-propylpiperidin-1-yl)propan-1-one.
What is the SMILES notation for 3-(ethylamino)-2-methyl-1-(2-propylpiperidin-1-yl)propan-1-one?
The canonical SMILES for 3-(ethylamino)-2-methyl-1-(2-propylpiperidin-1-yl)propan-1-one is CCCC1CCCCN1C(=O)C(C)CNCC.
What is the InChIKey of 3-(ethylamino)-2-methyl-1-(2-propylpiperidin-1-yl)propan-1-one?
The InChIKey is CGBAUUIYRCZONK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-4-8-13-9-6-7-10-16(13)14(17)12(3)11-15-5-2/h12-13,15H,4-11H2,1-3H3.
What are the key properties of 3-(ethylamino)-2-methyl-1-(2-propylpiperidin-1-yl)propan-1-one?
3-(ethylamino)-2-methyl-1-(2-propylpiperidin-1-yl)propan-1-one has a molecular weight of 240.39 g/mol, XLogP of 2.41, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(ethylamino)-2-methyl-1-(2-propylpiperidin-1-yl)propan-1-one is sourced from PubChem (CID 83052878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).