2-ethyl-N-(piperidin-4-ylmethyl)-N-propylbutanamide

C15H30N2O — CID 79721437

IUPAC2-ethyl-N-(piperidin-4-ylmethyl)-N-propylbutanamide
SMILESCCCN(CC1CCNCC1)C(=O)C(CC)CC
InChIInChI=1S/C15H30N2O/c1-4-11-17(15(18)14(5-2)6-3)12-13-7-9-16-10-8-13/h13-14,16H,4-12H2,1-3H3
InChIKeyUDAKCXWXOAACIH-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.66
Rot. Bonds7

About 2-ethyl-N-(piperidin-4-ylmethyl)-N-propylbutanamide

2-ethyl-N-(piperidin-4-ylmethyl)-N-propylbutanamide (PubChem CID 79721437) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is 2-ethyl-N-(piperidin-4-ylmethyl)-N-propylbutanamide.

Molecular Properties

Compound Name2-ethyl-N-(piperidin-4-ylmethyl)-N-propylbutanamide
PubChem CID79721437
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name2-ethyl-N-(piperidin-4-ylmethyl)-N-propylbutanamide
SMILESCCCN(CC1CCNCC1)C(=O)C(CC)CC
InChIInChI=1S/C15H30N2O/c1-4-11-17(15(18)14(5-2)6-3)12-13-7-9-16-10-8-13/h13-14,16H,4-12H2,1-3H3
InChIKeyUDAKCXWXOAACIH-UHFFFAOYSA-N
XLogP2.66
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(piperidin-4-ylmethyl)-N-propylcyclooctanecarboxamide
CID 79702518
N-(cyclopropylmethyl)-3-piperidin-4-yl-N-propylpropanamide
CID 62211914
3-cyclopropyl-1-(piperidin-4-ylmethyl)-1-propylurea
CID 79721029
N-ethyl-2-methyl-N-(piperidin-4-ylmethyl)propanamide
CID 79721124
N-(piperidin-4-ylmethyl)-N-propylpent-4-enamide
CID 79721360
2-tert-butylsulfanyl-N-(piperidin-4-ylmethyl)-N-propylacetamide
CID 79721209
5-oxo-N-(piperidin-4-ylmethyl)-N-propylpyrrolidine-2-carboxamide
CID 79721070
3-methyl-N-(piperidin-4-ylmethyl)-N-propylfuran-2-carboxamide
CID 79720557
2,2-dimethyl-N-(piperidin-4-ylmethyl)-N-propylcyclopentane-1-carboxamide
CID 107180947
4-iodo-N-(piperidin-4-ylmethyl)-N-propylbenzamide
CID 79721151
2-phenyl-N-(piperidin-4-ylmethyl)-N-propylacetamide
CID 79720329
2,6-dichloro-N-(piperidin-4-ylmethyl)-N-propylbenzamide
CID 79702520

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-(piperidin-4-ylmethyl)-N-propylbutanamide?
The IUPAC name of 2-ethyl-N-(piperidin-4-ylmethyl)-N-propylbutanamide (CID 79721437) is 2-ethyl-N-(piperidin-4-ylmethyl)-N-propylbutanamide.
What is the SMILES notation for 2-ethyl-N-(piperidin-4-ylmethyl)-N-propylbutanamide?
The canonical SMILES for 2-ethyl-N-(piperidin-4-ylmethyl)-N-propylbutanamide is CCCN(CC1CCNCC1)C(=O)C(CC)CC.
What is the InChIKey of 2-ethyl-N-(piperidin-4-ylmethyl)-N-propylbutanamide?
The InChIKey is UDAKCXWXOAACIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-4-11-17(15(18)14(5-2)6-3)12-13-7-9-16-10-8-13/h13-14,16H,4-12H2,1-3H3.
What are the key properties of 2-ethyl-N-(piperidin-4-ylmethyl)-N-propylbutanamide?
2-ethyl-N-(piperidin-4-ylmethyl)-N-propylbutanamide has a molecular weight of 254.42 g/mol, XLogP of 2.66, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-(piperidin-4-ylmethyl)-N-propylbutanamide is sourced from PubChem (CID 79721437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).