4-(4-amino-3-ethylpiperidin-1-yl)-N,N-diethylbutanamide

C15H31N3O — CID 81458870

IUPAC4-(4-amino-3-ethylpiperidin-1-yl)-N,N-diethylbutanamide
SMILESCCC1CN(CCCC(=O)N(CC)CC)CCC1N
InChIInChI=1S/C15H31N3O/c1-4-13-12-17(11-9-14(13)16)10-7-8-15(19)18(5-2)6-3/h13-14H,4-12,16H2,1-3H3
InChIKeyRIXULGAECACMPS-UHFFFAOYSA-N
MW269.43 g/mol
LogP1.69
Rot. Bonds7

About 4-(4-amino-3-ethylpiperidin-1-yl)-N,N-diethylbutanamide

4-(4-amino-3-ethylpiperidin-1-yl)-N,N-diethylbutanamide (PubChem CID 81458870) has the molecular formula C15H31N3O and a molecular weight of 269.43 g/mol. Its IUPAC name is 4-(4-amino-3-ethylpiperidin-1-yl)-N,N-diethylbutanamide.

Molecular Properties

Compound Name4-(4-amino-3-ethylpiperidin-1-yl)-N,N-diethylbutanamide
PubChem CID81458870
Molecular FormulaC15H31N3O
Molecular Weight269.43 g/mol
Exact Mass269.25
IUPAC Name4-(4-amino-3-ethylpiperidin-1-yl)-N,N-diethylbutanamide
SMILESCCC1CN(CCCC(=O)N(CC)CC)CCC1N
InChIInChI=1S/C15H31N3O/c1-4-13-12-17(11-9-14(13)16)10-7-8-15(19)18(5-2)6-3/h13-14H,4-12,16H2,1-3H3
InChIKeyRIXULGAECACMPS-UHFFFAOYSA-N
XLogP1.69
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.43
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(3S)-3-aminopyrrolidin-1-yl]-N,N-diethylbutanamide
CID 115302442
1-[4-(diethylamino)-4-oxobutyl]pyrrolidine-3-carboxylic acid
CID 63031858
3-ethyl-1-(3-methylbut-3-enyl)piperidin-4-amine
CID 114473405
methyl (3S)-1-[4-(diethylamino)-4-oxobutyl]piperidine-3-carboxylate
CID 115537485
2-(4-amino-3-ethylpiperidin-1-yl)ethanol
CID 81459105
1-[2-(diethylamino)ethyl]-3-ethylpiperidin-4-amine
CID 81458962
4-[2-(aminomethyl)morpholin-4-yl]-N,N-diethylbutanamide
CID 114398814
N,N-diethyl-4-[3-(2-hydroxyethyl)piperidin-1-yl]butanamide
CID 62356650
2-(4-amino-3-ethylpiperidin-1-yl)-N-cyclopropyl-N-methylacetamide
CID 81458982
ethyl 6-(3-ethyl-4-hydroxypiperidin-1-yl)hexanoate
CID 114511051
2-[2-(4-amino-3-ethylpiperidin-1-yl)ethoxy]ethanol
CID 81460608
3-ethyl-1-(2-piperidin-1-ylethyl)piperidin-4-amine
CID 81459970

Frequently Asked Questions

What is the IUPAC name of 4-(4-amino-3-ethylpiperidin-1-yl)-N,N-diethylbutanamide?
The IUPAC name of 4-(4-amino-3-ethylpiperidin-1-yl)-N,N-diethylbutanamide (CID 81458870) is 4-(4-amino-3-ethylpiperidin-1-yl)-N,N-diethylbutanamide.
What is the SMILES notation for 4-(4-amino-3-ethylpiperidin-1-yl)-N,N-diethylbutanamide?
The canonical SMILES for 4-(4-amino-3-ethylpiperidin-1-yl)-N,N-diethylbutanamide is CCC1CN(CCCC(=O)N(CC)CC)CCC1N.
What is the InChIKey of 4-(4-amino-3-ethylpiperidin-1-yl)-N,N-diethylbutanamide?
The InChIKey is RIXULGAECACMPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3O/c1-4-13-12-17(11-9-14(13)16)10-7-8-15(19)18(5-2)6-3/h13-14H,4-12,16H2,1-3H3.
What are the key properties of 4-(4-amino-3-ethylpiperidin-1-yl)-N,N-diethylbutanamide?
4-(4-amino-3-ethylpiperidin-1-yl)-N,N-diethylbutanamide has a molecular weight of 269.43 g/mol, XLogP of 1.69, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-amino-3-ethylpiperidin-1-yl)-N,N-diethylbutanamide is sourced from PubChem (CID 81458870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).