N-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethyl]propanamide

C14H29NO5 — CID 166555863

IUPACN-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethyl]propanamide
SMILESCCC(=O)NCCOCCOCCOCCOC(C)C
InChIInChI=1S/C14H29NO5/c1-4-14(16)15-5-6-17-7-8-18-9-10-19-11-12-20-13(2)3/h13H,4-12H2,1-3H3,(H,15,16)
InChIKeyVARNNNXIHSMMFM-UHFFFAOYSA-N
MW291.39 g/mol
LogP0.99
Rot. Bonds14

About N-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethyl]propanamide

N-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethyl]propanamide (PubChem CID 166555863) has the molecular formula C14H29NO5 and a molecular weight of 291.39 g/mol. Its IUPAC name is N-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethyl]propanamide.

Molecular Properties

Compound NameN-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethyl]propanamide
PubChem CID166555863
Molecular FormulaC14H29NO5
Molecular Weight291.39 g/mol
Exact Mass291.20
IUPAC NameN-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethyl]propanamide
SMILESCCC(=O)NCCOCCOCCOCCOC(C)C
InChIInChI=1S/C14H29NO5/c1-4-14(16)15-5-6-17-7-8-18-9-10-19-11-12-20-13(2)3/h13H,4-12H2,1-3H3,(H,15,16)
InChIKeyVARNNNXIHSMMFM-UHFFFAOYSA-N
XLogP0.99
TPSA66.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds14
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.39
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

4-methyl-N-[2-(2-propan-2-yloxyethoxy)ethyl]pentanamide
CID 176759210
N-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]propanamide
CID 122664379
ethane;N-[2-[2-[2-[2-(3-methylbutoxy)ethoxy]ethoxy]ethoxy]ethyl]propanamide
CID 171565273
molecular hydrogen;4-propan-2-yloxy-N-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethyl]butanamide
CID 155739531
N-[2-[2-[2-(butan-2-ylamino)ethoxy]ethoxy]ethyl]-2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]acetamide
CID 162749903
N-[2-(2-methylpropoxy)ethyl]propanamide
CID 115588549
N-[2-(2-butoxyethoxy)ethyl]propanamide
CID 153105198
N-[2-[2-(2-bromoethoxy)ethoxy]ethyl]propanamide
CID 154729990
N-[2-[2-[2-(ethylamino)ethoxy]ethoxy]ethyl]propanamide
CID 147425516
5-ethoxy-N-[2-(2-propan-2-yloxyethoxy)ethyl]pentanamide;molecular hydrogen
CID 177338018
molecular hydrogen;N-[2-oxo-2-[2-(2-oxobutoxy)ethylamino]ethyl]-3-(2-propan-2-yloxyethoxy)propanamide
CID 167464435
molecular hydrogen;N-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethyl]-3-[2-[[2-[2-(2-propoxyethoxy)ethoxy]acetyl]amino]ethoxy]propanamide
CID 176953270

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethyl]propanamide?
The IUPAC name of N-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethyl]propanamide (CID 166555863) is N-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethyl]propanamide.
What is the SMILES notation for N-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethyl]propanamide?
The canonical SMILES for N-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethyl]propanamide is CCC(=O)NCCOCCOCCOCCOC(C)C.
What is the InChIKey of N-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethyl]propanamide?
The InChIKey is VARNNNXIHSMMFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO5/c1-4-14(16)15-5-6-17-7-8-18-9-10-19-11-12-20-13(2)3/h13H,4-12H2,1-3H3,(H,15,16).
What are the key properties of N-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethyl]propanamide?
N-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethyl]propanamide has a molecular weight of 291.39 g/mol, XLogP of 0.99, 14 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethyl]propanamide is sourced from PubChem (CID 166555863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).