N-ethyl-N-(2-methylbutyl)-3-piperidin-4-ylbutanamide;hydrochloride

C16H33ClN2O — CID 119816159

IUPACN-ethyl-N-(2-methylbutyl)-3-piperidin-4-ylbutanamide;hydrochloride
SMILESCCC(C)CN(CC)C(=O)CC(C)C1CCNCC1.Cl
InChIInChI=1S/C16H32N2O.ClH/c1-5-13(3)12-18(6-2)16(19)11-14(4)15-7-9-17-10-8-15;/h13-15,17H,5-12H2,1-4H3;1H
InChIKeyUTSGALUVJRAGDJ-UHFFFAOYSA-N
MW304.91 g/mol
LogP3.33
Rot. Bonds7

About N-ethyl-N-(2-methylbutyl)-3-piperidin-4-ylbutanamide;hydrochloride

N-ethyl-N-(2-methylbutyl)-3-piperidin-4-ylbutanamide;hydrochloride (PubChem CID 119816159) has the molecular formula C16H33ClN2O and a molecular weight of 304.91 g/mol. Its IUPAC name is N-ethyl-N-(2-methylbutyl)-3-piperidin-4-ylbutanamide;hydrochloride.

Molecular Properties

Compound NameN-ethyl-N-(2-methylbutyl)-3-piperidin-4-ylbutanamide;hydrochloride
PubChem CID119816159
Molecular FormulaC16H33ClN2O
Molecular Weight304.91 g/mol
Exact Mass304.23
IUPAC NameN-ethyl-N-(2-methylbutyl)-3-piperidin-4-ylbutanamide;hydrochloride
SMILESCCC(C)CN(CC)C(=O)CC(C)C1CCNCC1.Cl
InChIInChI=1S/C16H32N2O.ClH/c1-5-13(3)12-18(6-2)16(19)11-14(4)15-7-9-17-10-8-15;/h13-15,17H,5-12H2,1-4H3;1H
InChIKeyUTSGALUVJRAGDJ-UHFFFAOYSA-N
XLogP3.33
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.91
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-N-(2-methylpropyl)-3-piperidin-4-ylbutanamide
CID 119732319
N-(2-methylpropyl)-N-pentan-3-yl-3-piperidin-4-ylbutanamide;hydrochloride
CID 119816024
N-cyclopropyl-N-ethyl-3-piperidin-4-ylbutanamide
CID 119718930
N-ethyl-N-(2-methylbutyl)piperidine-4-carboxamide
CID 79470658
N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)-3-piperidin-4-ylbutanamide
CID 119728999
N-ethyl-N-(2-ethylbutyl)-3-piperidin-3-ylbutanamide
CID 81044581
N-ethyl-3-piperidin-4-yl-N-(thiophen-2-ylmethyl)butanamide;hydrochloride
CID 119690004
N,N-bis(2-methoxyethyl)-3-piperidin-4-ylbutanamide
CID 119672639
N-(dicyclopropylmethyl)-N-methyl-3-piperidin-4-ylbutanamide;hydrochloride
CID 119760613
N-(4-methylhexan-2-yl)-3-piperidin-4-ylbutanamide;hydrochloride
CID 119789209
N-butan-2-yl-3-piperidin-4-ylbutanamide
CID 119669606
N-(4,4-dimethylcyclohexyl)-N-methyl-3-piperidin-4-ylbutanamide;hydrochloride
CID 119791939

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(2-methylbutyl)-3-piperidin-4-ylbutanamide;hydrochloride?
The IUPAC name of N-ethyl-N-(2-methylbutyl)-3-piperidin-4-ylbutanamide;hydrochloride (CID 119816159) is N-ethyl-N-(2-methylbutyl)-3-piperidin-4-ylbutanamide;hydrochloride.
What is the SMILES notation for N-ethyl-N-(2-methylbutyl)-3-piperidin-4-ylbutanamide;hydrochloride?
The canonical SMILES for N-ethyl-N-(2-methylbutyl)-3-piperidin-4-ylbutanamide;hydrochloride is CCC(C)CN(CC)C(=O)CC(C)C1CCNCC1.Cl.
What is the InChIKey of N-ethyl-N-(2-methylbutyl)-3-piperidin-4-ylbutanamide;hydrochloride?
The InChIKey is UTSGALUVJRAGDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O.ClH/c1-5-13(3)12-18(6-2)16(19)11-14(4)15-7-9-17-10-8-15;/h13-15,17H,5-12H2,1-4H3;1H.
What are the key properties of N-ethyl-N-(2-methylbutyl)-3-piperidin-4-ylbutanamide;hydrochloride?
N-ethyl-N-(2-methylbutyl)-3-piperidin-4-ylbutanamide;hydrochloride has a molecular weight of 304.91 g/mol, XLogP of 3.33, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(2-methylbutyl)-3-piperidin-4-ylbutanamide;hydrochloride is sourced from PubChem (CID 119816159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).