2-ethyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylhexanamide

C17H34N2O — CID 106628997

IUPAC2-ethyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylhexanamide
SMILESCCCCC(CC)C(=O)N(CC1CCCNC1)C(C)C
InChIInChI=1S/C17H34N2O/c1-5-7-10-16(6-2)17(20)19(14(3)4)13-15-9-8-11-18-12-15/h14-16,18H,5-13H2,1-4H3
InChIKeyZUMMFPQNQHEYMG-UHFFFAOYSA-N
MW282.47 g/mol
LogP3.44
Rot. Bonds8

About 2-ethyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylhexanamide

2-ethyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylhexanamide (PubChem CID 106628997) has the molecular formula C17H34N2O and a molecular weight of 282.47 g/mol. Its IUPAC name is 2-ethyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylhexanamide.

Molecular Properties

Compound Name2-ethyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylhexanamide
PubChem CID106628997
Molecular FormulaC17H34N2O
Molecular Weight282.47 g/mol
Exact Mass282.27
IUPAC Name2-ethyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylhexanamide
SMILESCCCCC(CC)C(=O)N(CC1CCCNC1)C(C)C
InChIInChI=1S/C17H34N2O/c1-5-7-10-16(6-2)17(20)19(14(3)4)13-15-9-8-11-18-12-15/h14-16,18H,5-13H2,1-4H3
InChIKeyZUMMFPQNQHEYMG-UHFFFAOYSA-N
XLogP3.44
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.47
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,2-diethyl-N-piperidin-3-ylhexanamide
CID 60807236
N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclobutanecarboxamide
CID 106629002
1-methyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclopentane-1-carboxamide
CID 106629148
N-(piperidin-3-ylmethyl)-N-propan-2-yl-2-propan-2-yloxyacetamide
CID 106628870
N-ethyl-N-(piperidin-3-ylmethyl)nonan-2-amine
CID 106624638
1-methyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclohexane-1-carboxamide
CID 106828147
3-cyclohexyl-1-(piperidin-3-ylmethyl)-1-propan-2-ylurea
CID 106629886
N-(piperidin-3-ylmethyl)-N-propan-2-ylthiolane-2-carboxamide
CID 106629118
(3R)-3-(2-methylhexyl)piperidine
CID 155456169
N-(piperidin-3-ylmethyl)-N-propan-2-yl-3-pyrrolidin-1-ylpropanamide
CID 106628895
N-pentan-3-yl-2-[piperidin-3-ylmethyl(propan-2-yl)amino]acetamide
CID 106637889
2-[ethyl(piperidin-3-ylmethyl)sulfamoyl]propanoic acid
CID 106631065

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylhexanamide?
The IUPAC name of 2-ethyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylhexanamide (CID 106628997) is 2-ethyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylhexanamide.
What is the SMILES notation for 2-ethyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylhexanamide?
The canonical SMILES for 2-ethyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylhexanamide is CCCCC(CC)C(=O)N(CC1CCCNC1)C(C)C.
What is the InChIKey of 2-ethyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylhexanamide?
The InChIKey is ZUMMFPQNQHEYMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2O/c1-5-7-10-16(6-2)17(20)19(14(3)4)13-15-9-8-11-18-12-15/h14-16,18H,5-13H2,1-4H3.
What are the key properties of 2-ethyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylhexanamide?
2-ethyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylhexanamide has a molecular weight of 282.47 g/mol, XLogP of 3.44, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylhexanamide is sourced from PubChem (CID 106628997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).