N-ethyl-2-[4-[(2-methoxyethylamino)methyl]piperidin-1-yl]acetamide

C13H27N3O2 — CID 63847405

IUPACN-ethyl-2-[4-[(2-methoxyethylamino)methyl]piperidin-1-yl]acetamide
SMILESCCNC(=O)CN1CCC(CNCCOC)CC1
InChIInChI=1S/C13H27N3O2/c1-3-15-13(17)11-16-7-4-12(5-8-16)10-14-6-9-18-2/h12,14H,3-11H2,1-2H3,(H,15,17)
InChIKeyVRCBZBYRDHVSDG-UHFFFAOYSA-N
MW257.38 g/mol
LogP0.07
Rot. Bonds8

About N-ethyl-2-[4-[(2-methoxyethylamino)methyl]piperidin-1-yl]acetamide

N-ethyl-2-[4-[(2-methoxyethylamino)methyl]piperidin-1-yl]acetamide (PubChem CID 63847405) has the molecular formula C13H27N3O2 and a molecular weight of 257.38 g/mol. Its IUPAC name is N-ethyl-2-[4-[(2-methoxyethylamino)methyl]piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-ethyl-2-[4-[(2-methoxyethylamino)methyl]piperidin-1-yl]acetamide
PubChem CID63847405
Molecular FormulaC13H27N3O2
Molecular Weight257.38 g/mol
Exact Mass257.21
IUPAC NameN-ethyl-2-[4-[(2-methoxyethylamino)methyl]piperidin-1-yl]acetamide
SMILESCCNC(=O)CN1CCC(CNCCOC)CC1
InChIInChI=1S/C13H27N3O2/c1-3-15-13(17)11-16-7-4-12(5-8-16)10-14-6-9-18-2/h12,14H,3-11H2,1-2H3,(H,15,17)
InChIKeyVRCBZBYRDHVSDG-UHFFFAOYSA-N
XLogP0.07
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.38
LogP ≤ 50.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(2-methoxyethyl)-2-[4-(propylaminomethyl)piperidin-1-yl]acetamide
CID 55258549
2-[1-[2-(2-methoxyethylamino)-2-oxoethyl]piperidin-4-yl]acetic acid
CID 79608279
2-[4-[(2-methoxyethylamino)methyl]piperidin-1-yl]-N,N-dimethylacetamide
CID 55257781
N-(cyclopropylmethyl)-2-[4-(ethylaminomethyl)piperidin-1-yl]acetamide
CID 63848050
2-[4-[(tert-butylamino)methyl]piperidin-1-yl]-N-ethylacetamide
CID 63849644
2-(4-hydroxypiperidin-1-yl)-N-(2-methoxyethyl)acetamide
CID 27070086
N-butyl-2-[4-(ethylaminomethyl)piperidin-1-yl]acetamide
CID 63847877
N-(cyanomethyl)-2-[4-(ethylaminomethyl)piperidin-1-yl]acetamide
CID 63847348
2-[4-[(2-methoxyethylamino)methyl]piperidin-1-yl]-N-methyl-N-propan-2-ylacetamide
CID 63848275
2-[3-[(2-methoxyethylamino)methyl]piperidin-1-yl]-N-(3-methoxypropyl)acetamide
CID 63849542
3-[[2-(4-aminopiperidin-1-yl)acetyl]amino]-N-(2-methoxyethyl)propanamide
CID 115738482
N-ethyl-2-(2-methoxyethylamino)acetamide
CID 28565523

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[4-[(2-methoxyethylamino)methyl]piperidin-1-yl]acetamide?
The IUPAC name of N-ethyl-2-[4-[(2-methoxyethylamino)methyl]piperidin-1-yl]acetamide (CID 63847405) is N-ethyl-2-[4-[(2-methoxyethylamino)methyl]piperidin-1-yl]acetamide.
What is the SMILES notation for N-ethyl-2-[4-[(2-methoxyethylamino)methyl]piperidin-1-yl]acetamide?
The canonical SMILES for N-ethyl-2-[4-[(2-methoxyethylamino)methyl]piperidin-1-yl]acetamide is CCNC(=O)CN1CCC(CNCCOC)CC1.
What is the InChIKey of N-ethyl-2-[4-[(2-methoxyethylamino)methyl]piperidin-1-yl]acetamide?
The InChIKey is VRCBZBYRDHVSDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3O2/c1-3-15-13(17)11-16-7-4-12(5-8-16)10-14-6-9-18-2/h12,14H,3-11H2,1-2H3,(H,15,17).
What are the key properties of N-ethyl-2-[4-[(2-methoxyethylamino)methyl]piperidin-1-yl]acetamide?
N-ethyl-2-[4-[(2-methoxyethylamino)methyl]piperidin-1-yl]acetamide has a molecular weight of 257.38 g/mol, XLogP of 0.07, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[4-[(2-methoxyethylamino)methyl]piperidin-1-yl]acetamide is sourced from PubChem (CID 63847405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).