N,N-bis(2-ethoxyethyl)-2,2-dimethylpropanamide

C13H27NO3 — CID 82952265

IUPACN,N-bis(2-ethoxyethyl)-2,2-dimethylpropanamide
SMILESCCOCCN(CCOCC)C(=O)C(C)(C)C
InChIInChI=1S/C13H27NO3/c1-6-16-10-8-14(9-11-17-7-2)12(15)13(3,4)5/h6-11H2,1-5H3
InChIKeyWRWBSCBGSCIDSH-UHFFFAOYSA-N
MW245.36 g/mol
LogP1.93
Rot. Bonds8

About N,N-bis(2-ethoxyethyl)-2,2-dimethylpropanamide

N,N-bis(2-ethoxyethyl)-2,2-dimethylpropanamide (PubChem CID 82952265) has the molecular formula C13H27NO3 and a molecular weight of 245.36 g/mol. Its IUPAC name is N,N-bis(2-ethoxyethyl)-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN,N-bis(2-ethoxyethyl)-2,2-dimethylpropanamide
PubChem CID82952265
Molecular FormulaC13H27NO3
Molecular Weight245.36 g/mol
Exact Mass245.20
IUPAC NameN,N-bis(2-ethoxyethyl)-2,2-dimethylpropanamide
SMILESCCOCCN(CCOCC)C(=O)C(C)(C)C
InChIInChI=1S/C13H27NO3/c1-6-16-10-8-14(9-11-17-7-2)12(15)13(3,4)5/h6-11H2,1-5H3
InChIKeyWRWBSCBGSCIDSH-UHFFFAOYSA-N
XLogP1.93
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.36
LogP ≤ 51.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1,1,3,3-tetrakis(2-ethoxyethyl)urea
CID 54341985
N-(2-ethoxyethyl)-N-ethyl-2-methyl-2-(methylamino)propanamide
CID 63690570
2,2-dimethyl-N,N-dipropylpropanamide;methane
CID 157106915
N-(2-ethoxyethyl)-N-ethyl-2-(methylamino)acetamide
CID 63691454
N-(2-ethoxyethyl)-2-methoxy-N,2-dimethylpropanamide
CID 103896451
(2R)-2-amino-N,N-bis(2-ethoxyethyl)-3-methylbutanamide
CID 82966284
N,N-bis(2-chloroethyl)-2,2-dimethylpropanamide
CID 79019595
2,2-dimethyl-N,N-di(nonyl)propanamide
CID 532840
2-(4-aminophenyl)-N-(2-ethoxyethyl)-N-ethyl-2-methylpropanamide
CID 80556703
(2R)-2-amino-N-(2-ethoxyethyl)-N-ethyl-3-methylbutanamide
CID 79013546
3-[bis(2-ethoxyethyl)amino]-2,2-dimethylpropanoic acid
CID 82951535
2-bromo-N,N-bis(2-ethoxyethyl)butanamide
CID 82966254

Frequently Asked Questions

What is the IUPAC name of N,N-bis(2-ethoxyethyl)-2,2-dimethylpropanamide?
The IUPAC name of N,N-bis(2-ethoxyethyl)-2,2-dimethylpropanamide (CID 82952265) is N,N-bis(2-ethoxyethyl)-2,2-dimethylpropanamide.
What is the SMILES notation for N,N-bis(2-ethoxyethyl)-2,2-dimethylpropanamide?
The canonical SMILES for N,N-bis(2-ethoxyethyl)-2,2-dimethylpropanamide is CCOCCN(CCOCC)C(=O)C(C)(C)C.
What is the InChIKey of N,N-bis(2-ethoxyethyl)-2,2-dimethylpropanamide?
The InChIKey is WRWBSCBGSCIDSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO3/c1-6-16-10-8-14(9-11-17-7-2)12(15)13(3,4)5/h6-11H2,1-5H3.
What are the key properties of N,N-bis(2-ethoxyethyl)-2,2-dimethylpropanamide?
N,N-bis(2-ethoxyethyl)-2,2-dimethylpropanamide has a molecular weight of 245.36 g/mol, XLogP of 1.93, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(2-ethoxyethyl)-2,2-dimethylpropanamide is sourced from PubChem (CID 82952265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).