2-(2-methoxyethylamino)-N-(3-methyl-2-pyrrolidin-1-ylbutyl)acetamide

C14H29N3O2 — CID 79282670

IUPAC2-(2-methoxyethylamino)-N-(3-methyl-2-pyrrolidin-1-ylbutyl)acetamide
SMILESCOCCNCC(=O)NCC(C(C)C)N1CCCC1
InChIInChI=1S/C14H29N3O2/c1-12(2)13(17-7-4-5-8-17)10-16-14(18)11-15-6-9-19-3/h12-13,15H,4-11H2,1-3H3,(H,16,18)
InChIKeyDDTDNZZYRLPKOY-UHFFFAOYSA-N
MW271.40 g/mol
LogP0.46
Rot. Bonds9

About 2-(2-methoxyethylamino)-N-(3-methyl-2-pyrrolidin-1-ylbutyl)acetamide

2-(2-methoxyethylamino)-N-(3-methyl-2-pyrrolidin-1-ylbutyl)acetamide (PubChem CID 79282670) has the molecular formula C14H29N3O2 and a molecular weight of 271.40 g/mol. Its IUPAC name is 2-(2-methoxyethylamino)-N-(3-methyl-2-pyrrolidin-1-ylbutyl)acetamide.

Molecular Properties

Compound Name2-(2-methoxyethylamino)-N-(3-methyl-2-pyrrolidin-1-ylbutyl)acetamide
PubChem CID79282670
Molecular FormulaC14H29N3O2
Molecular Weight271.40 g/mol
Exact Mass271.23
IUPAC Name2-(2-methoxyethylamino)-N-(3-methyl-2-pyrrolidin-1-ylbutyl)acetamide
SMILESCOCCNCC(=O)NCC(C(C)C)N1CCCC1
InChIInChI=1S/C14H29N3O2/c1-12(2)13(17-7-4-5-8-17)10-16-14(18)11-15-6-9-19-3/h12-13,15H,4-11H2,1-3H3,(H,16,18)
InChIKeyDDTDNZZYRLPKOY-UHFFFAOYSA-N
XLogP0.46
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.40
LogP ≤ 50.46
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

2-(methylamino)-N-(3-methyl-2-pyrrolidin-1-ylbutyl)acetamide
CID 61276217
3-methyl-N-(3-methyl-2-piperidin-1-ylbutyl)butanamide
CID 110402825
2-(2-methoxyethylamino)-N-[2-(4-methylpiperidin-1-yl)propyl]acetamide;dihydrochloride
CID 119866597
4-amino-N-(3-methyl-2-pyrrolidin-1-ylbutyl)butanamide
CID 61275431
N-(3-methyl-2-pyrrolidin-1-ylbutyl)pentanamide
CID 110402962
3-(tert-butylamino)-N-(3-methyl-2-pyrrolidin-1-ylbutyl)propanamide
CID 61276030
2-(2-methoxyethylamino)-N-[2-(2-methoxyphenyl)-2-piperidin-1-ylethyl]acetamide;dihydrochloride
CID 119849351
2-(2-methoxyethylamino)-N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]acetamide
CID 119832222
N-(2,3-dihydroxypropyl)-2-(2-methoxyethylamino)acetamide
CID 79291770
3-methyl-5-[(3-methyl-2-pyrrolidin-1-ylbutyl)amino]-5-oxopentanoic acid
CID 62964716
N-(2-cyclopropyl-2-hydroxyethyl)-2-(2-methoxyethylamino)acetamide
CID 79280826
N-(2-methoxyethyl)-2-[[2-(2-methylpropylamino)-2-oxoethyl]amino]acetamide
CID 112683626

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethylamino)-N-(3-methyl-2-pyrrolidin-1-ylbutyl)acetamide?
The IUPAC name of 2-(2-methoxyethylamino)-N-(3-methyl-2-pyrrolidin-1-ylbutyl)acetamide (CID 79282670) is 2-(2-methoxyethylamino)-N-(3-methyl-2-pyrrolidin-1-ylbutyl)acetamide.
What is the SMILES notation for 2-(2-methoxyethylamino)-N-(3-methyl-2-pyrrolidin-1-ylbutyl)acetamide?
The canonical SMILES for 2-(2-methoxyethylamino)-N-(3-methyl-2-pyrrolidin-1-ylbutyl)acetamide is COCCNCC(=O)NCC(C(C)C)N1CCCC1.
What is the InChIKey of 2-(2-methoxyethylamino)-N-(3-methyl-2-pyrrolidin-1-ylbutyl)acetamide?
The InChIKey is DDTDNZZYRLPKOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O2/c1-12(2)13(17-7-4-5-8-17)10-16-14(18)11-15-6-9-19-3/h12-13,15H,4-11H2,1-3H3,(H,16,18).
What are the key properties of 2-(2-methoxyethylamino)-N-(3-methyl-2-pyrrolidin-1-ylbutyl)acetamide?
2-(2-methoxyethylamino)-N-(3-methyl-2-pyrrolidin-1-ylbutyl)acetamide has a molecular weight of 271.40 g/mol, XLogP of 0.46, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethylamino)-N-(3-methyl-2-pyrrolidin-1-ylbutyl)acetamide is sourced from PubChem (CID 79282670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).