(2R)-2-(butylamino)-N-[2-[2-(2-oxoethoxy)ethoxy]ethyl]propanamide

C13H26N2O4 — CID 156870519

IUPAC(2R)-2-(butylamino)-N-[2-[2-(2-oxoethoxy)ethoxy]ethyl]propanamide
SMILESCCCCN[C@H](C)C(=O)NCCOCCOCC=O
InChIInChI=1S/C13H26N2O4/c1-3-4-5-14-12(2)13(17)15-6-8-18-10-11-19-9-7-16/h7,12,14H,3-6,8-11H2,1-2H3,(H,15,17)/t12-/m1/s1
InChIKeyUDARUESCTUDLFT-GFCCVEGCSA-N
MW274.36 g/mol
LogP0.11
Rot. Bonds13

About (2R)-2-(butylamino)-N-[2-[2-(2-oxoethoxy)ethoxy]ethyl]propanamide

(2R)-2-(butylamino)-N-[2-[2-(2-oxoethoxy)ethoxy]ethyl]propanamide (PubChem CID 156870519) has the molecular formula C13H26N2O4 and a molecular weight of 274.36 g/mol. Its IUPAC name is (2R)-2-(butylamino)-N-[2-[2-(2-oxoethoxy)ethoxy]ethyl]propanamide.

Molecular Properties

Compound Name(2R)-2-(butylamino)-N-[2-[2-(2-oxoethoxy)ethoxy]ethyl]propanamide
PubChem CID156870519
Molecular FormulaC13H26N2O4
Molecular Weight274.36 g/mol
Exact Mass274.19
IUPAC Name(2R)-2-(butylamino)-N-[2-[2-(2-oxoethoxy)ethoxy]ethyl]propanamide
SMILESCCCCN[C@H](C)C(=O)NCCOCCOCC=O
InChIInChI=1S/C13H26N2O4/c1-3-4-5-14-12(2)13(17)15-6-8-18-10-11-19-9-7-16/h7,12,14H,3-6,8-11H2,1-2H3,(H,15,17)/t12-/m1/s1
InChIKeyUDARUESCTUDLFT-GFCCVEGCSA-N
XLogP0.11
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds13
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 50.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-butoxy-N-[2-[2-(2-oxoethoxy)ethoxy]ethyl]acetamide
CID 172626027
N-[2-[2-[2-(2-oxoethoxy)ethoxy]ethoxy]ethyl]propanamide
CID 163401026
N-(2-methoxyethyl)-2-(nonylamino)propanamide
CID 115574851
butyl N-[2-(2-oxoethoxy)ethyl]carbamate
CID 142734948
2-(butylamino)-N-(3-methylbutyl)propanamide
CID 43112967
N-(3-methoxypropyl)-2-(3-propoxypropylamino)propanamide
CID 82943912
2-(3-butoxypropylamino)-N-pentan-2-ylpropanamide
CID 115577400
2-(3-methoxypropylamino)-N-pentylpropanamide
CID 43131874
ethane;2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]acetaldehyde
CID 171646622
N-butyl-2-(3-cyclopropylpropylamino)propanamide
CID 115638941
methyl 2-[2-[2-(2-butoxyethoxy)ethoxy]ethylamino]propanoate
CID 104561977
2-bromo-N-(2-butoxyethyl)propanamide
CID 107904787

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(butylamino)-N-[2-[2-(2-oxoethoxy)ethoxy]ethyl]propanamide?
The IUPAC name of (2R)-2-(butylamino)-N-[2-[2-(2-oxoethoxy)ethoxy]ethyl]propanamide (CID 156870519) is (2R)-2-(butylamino)-N-[2-[2-(2-oxoethoxy)ethoxy]ethyl]propanamide.
What is the SMILES notation for (2R)-2-(butylamino)-N-[2-[2-(2-oxoethoxy)ethoxy]ethyl]propanamide?
The canonical SMILES for (2R)-2-(butylamino)-N-[2-[2-(2-oxoethoxy)ethoxy]ethyl]propanamide is CCCCN[C@H](C)C(=O)NCCOCCOCC=O.
What is the InChIKey of (2R)-2-(butylamino)-N-[2-[2-(2-oxoethoxy)ethoxy]ethyl]propanamide?
The InChIKey is UDARUESCTUDLFT-GFCCVEGCSA-N. The full InChI is InChI=1S/C13H26N2O4/c1-3-4-5-14-12(2)13(17)15-6-8-18-10-11-19-9-7-16/h7,12,14H,3-6,8-11H2,1-2H3,(H,15,17)/t12-/m1/s1.
What are the key properties of (2R)-2-(butylamino)-N-[2-[2-(2-oxoethoxy)ethoxy]ethyl]propanamide?
(2R)-2-(butylamino)-N-[2-[2-(2-oxoethoxy)ethoxy]ethyl]propanamide has a molecular weight of 274.36 g/mol, XLogP of 0.11, 13 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(butylamino)-N-[2-[2-(2-oxoethoxy)ethoxy]ethyl]propanamide is sourced from PubChem (CID 156870519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).