2-ethyl-N-[(3-methylpiperidin-2-yl)methyl]hexanamide

C15H30N2O — CID 63304747

IUPAC2-ethyl-N-[(3-methylpiperidin-2-yl)methyl]hexanamide
SMILESCCCCC(CC)C(=O)NCC1NCCCC1C
InChIInChI=1S/C15H30N2O/c1-4-6-9-13(5-2)15(18)17-11-14-12(3)8-7-10-16-14/h12-14,16H,4-11H2,1-3H3,(H,17,18)
InChIKeyUQSVYDZONVYTPQ-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.71
Rot. Bonds7

About 2-ethyl-N-[(3-methylpiperidin-2-yl)methyl]hexanamide

2-ethyl-N-[(3-methylpiperidin-2-yl)methyl]hexanamide (PubChem CID 63304747) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is 2-ethyl-N-[(3-methylpiperidin-2-yl)methyl]hexanamide.

Molecular Properties

Compound Name2-ethyl-N-[(3-methylpiperidin-2-yl)methyl]hexanamide
PubChem CID63304747
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name2-ethyl-N-[(3-methylpiperidin-2-yl)methyl]hexanamide
SMILESCCCCC(CC)C(=O)NCC1NCCCC1C
InChIInChI=1S/C15H30N2O/c1-4-6-9-13(5-2)15(18)17-11-14-12(3)8-7-10-16-14/h12-14,16H,4-11H2,1-3H3,(H,17,18)
InChIKeyUQSVYDZONVYTPQ-UHFFFAOYSA-N
XLogP2.71
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(3-methylpiperidin-2-yl)methyl]acetamide
CID 63305307
1-[(3-methylpiperidin-2-yl)methyl]-3-propylurea
CID 63304890
N-[(3-methylpiperidin-2-yl)methyl]-2-methylsulfonylpropanamide
CID 113421960
1-ethyl-3-[(3-methylpiperidin-2-yl)methyl]urea
CID 63304934
1,1-diethyl-3-[(3-methylpiperidin-2-yl)methyl]urea
CID 79161560
1,1-dimethyl-3-[(3-methylpiperidin-2-yl)methyl]urea
CID 79154184
N-[(3-methylpiperidin-2-yl)methyl]-2-propoxyacetamide
CID 107938590
2-ethyl-N-[2-(2-ethylhexanoylamino)ethyl]hexanamide
CID 4675082
2-ethyl-N-[(3-hydroxycyclopentyl)methyl]hexanamide
CID 103279742
N-cyclopentyl-2-ethylhexanamide
CID 4146053
2-ethyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]butanamide
CID 104972087
2-ethyl-N-pentylhexanamide
CID 5123867

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-[(3-methylpiperidin-2-yl)methyl]hexanamide?
The IUPAC name of 2-ethyl-N-[(3-methylpiperidin-2-yl)methyl]hexanamide (CID 63304747) is 2-ethyl-N-[(3-methylpiperidin-2-yl)methyl]hexanamide.
What is the SMILES notation for 2-ethyl-N-[(3-methylpiperidin-2-yl)methyl]hexanamide?
The canonical SMILES for 2-ethyl-N-[(3-methylpiperidin-2-yl)methyl]hexanamide is CCCCC(CC)C(=O)NCC1NCCCC1C.
What is the InChIKey of 2-ethyl-N-[(3-methylpiperidin-2-yl)methyl]hexanamide?
The InChIKey is UQSVYDZONVYTPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-4-6-9-13(5-2)15(18)17-11-14-12(3)8-7-10-16-14/h12-14,16H,4-11H2,1-3H3,(H,17,18).
What are the key properties of 2-ethyl-N-[(3-methylpiperidin-2-yl)methyl]hexanamide?
2-ethyl-N-[(3-methylpiperidin-2-yl)methyl]hexanamide has a molecular weight of 254.42 g/mol, XLogP of 2.71, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-[(3-methylpiperidin-2-yl)methyl]hexanamide is sourced from PubChem (CID 63304747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).